AG000382

1009298-59-2 | Benzamide, 3-[2,4-bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl]-N-methyl-

AG000382

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CAS Number	1009298-59-2
Catalog Number	AG000382(AGN-PC-0WA7WU)
Chemical Name	Benzamide, 3-[2,4-bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl]-N-methyl-
IUPAC Name	3-[2,4-bis[(3S)-3-methylmorpholin-4-yl]pyrido[2,3-d]pyrimidin-7-yl]-N-methylbenzamide
InChI	InChI=1S/C25H30N6O3/c1-16-14-33-11-9-30(16)23-20-7-8-21(18-5-4-6-19(13-18)24(32)26-3)27-22(20)28-25(29-23)31-10-12-34-15-17(31)2/h4-8,13,16-17H,9-12,14-15H2,1-3H3,(H,26,32)/t16-,17-/m0/s1
InChI Key	JUSFANSTBFGBAF-IRXDYDNUSA-N
MDL Number	MFCD22628784
Molecular Formula	C25H30N6O3
Molecular Weight	462.5441
SMILES	C[C@@H]1N(c2c3c(nc(n2)N2[C@@H](C)COCC2)nc(cc3)c2cc(C(=O)NC)ccc2)CCOC1
UNII	0BSC3P4H5X
Synonyms	AZD2014, AZD2014, 1009298-59-2, Vistusertib, AZD-2014, AZD 2014, UNII-0BSC3P4H5X, vistusertib (AZD2014), 0BSC3P4H5X, cc-551, 3-[2,4-Bis((3S)-3-methylmorpholin-4-yl)pyrido[5,6-e]pyrimidin-7-yl]-N-methylbenzamide, CHEMBL2336325, 3-[2,4-Bis((3S)-3-methyLmorpholin-4-yl)pyrido-[5,6-e]pyrimidin-7-yl]-N-methylbenzamide, C25H30N6O3, 3-(2,4-bis((S)-3-methylmorpholino)pyrido[2,3-d]pyrimidin-7-yl)-N-methylbenzamide, 3-[2,4-bis[(3S)-3-methylmorpholin-4-yl]pyrido[2,3-d]pyrimidin-7-yl]-N-methylbenzamide, Benzamide, 3-(2,4-bis((3S)-3-methyl-4-morpholinyl)pyrido(2,3-d)pyrimidin-7-yl)-N-methyl-, Vistusertib [INN], Benzamide, 3-[2,4-bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl]-N-methyl-, Vistusertib [USAN], Vistusertib (JAN/INN), MLS006011011, SCHEMBL290672, GTPL7699, AOB3574, DTXSID20143584, EX-A155, SYN1167, BCP05748, KS-000000YA, BDBM50429701, MFCD22628784, s2783, ZINC59258964, AKOS024464879, BCP9000362, CS-0701, DB11925, QC-4554, SB16565, NCGC00346698-11, 4CA-0223, AC-28425, AS-16302, BC600520, HY-15247, SC-62590, SMR004702809, AB0095803, SW219704-1, X3569, D10887, W-5962, J-000268, 3-[2,4-Bis-[(3S)-3-methyl-4-morpholinyl]-pyrido[2,3-d]pyrimidin-7-yl]-N-methylbenzamide, D0Z2UQ, A8373, Vistusertib, 98%, a novel mTOR inhibitor - 100MG 100mg,

Complexity	698
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	462.238g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	462.554g/mol
Monoisotopic Mass	462.238g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	92.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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