AG0038EM

845714-00-3 | 1,5,6,7-Tetrahydro-2-(4-pyridinyl)-4H-pyrrolo[3,2-c]pyridin-4-one

AG0038EM

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CAS Number	845714-00-3
Catalog Number	AG0038EM(AGN-PC-00EP4I)
Chemical Name	1,5,6,7-Tetrahydro-2-(4-pyridinyl)-4H-pyrrolo[3,2-c]pyridin-4-one
IUPAC Name	2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
InChI	InChI=1S/C12H11N3O/c16-12-9-7-11(8-1-4-13-5-2-8)15-10(9)3-6-14-12/h1-2,4-5,7,15H,3,6H2,(H,14,16)
InChI Key	DKXHSOUZPMHNIZ-UHFFFAOYSA-N
MDL Number	MFCD11870790
Molecular Formula	C12H11N3O
Molecular Weight	213.2352
SMILES	N1=CC=C(C=C1)C1=CC=2C(NCCC2N1)=O
Synonyms	PHA 767491, PHA-767491, PHA767491, PHA-767491, 845714-00-3, PHA 767491, CAY10572(PHA-767491), 1,5,6,7-Tetrahydro-2-(4-pyridinyl)-4H-pyrrolo[3,2-c]pyridin-4-one, PHA-767491 (CAY10572), 2-Pyridin-4-yl-1,5,6,7-tetrahydro-pyrrolo[3,2-c]pyridin-4-one, 2-(pyridin-4-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one, CAY10572, Pyrrolopyridinone, 1, Cdc7/Cdk9 Inhibitor, Kinome_2973, JMC502647 Compound 8, MLS006011036, CHEMBL225519, GTPL8763, SCHEMBL4767679, BDBM27344, CHEBI:95058, CTK8F8505, DTXSID50471069, HMS3229B21, HMS3656P19, BCP02855, PHA-767491A, 2651AH, PHA767491, s2742, ZINC16052718, AKOS026674124, compound 8 [PMID: 17480064], CS-1208, SB19465, NCGC00346723-01, HY-13461, SMR004702829, FT-0700494, SW219878-1, W-5495, 2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one, 2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one, 845714-00-3 pound not PHA767491 pound not PHA 767491, CAY-10572|||2-Pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one, D03DZO, cc-260, C12H11N3O, CID11715767, A3721, A11164, 8-pyridin-4-yl-4,9-diazabicyclo[4.3.0]nona-7,10-dien-5-one, 2-(Pyridin-4-Yl)-1,5,6,7-Tetrahydro-4h-Pyrrolo[3,2-C]pyridin-4-One, 2-(pyridin-4-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one HCl,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	213.24g/mol
Monoisotopic Mass	213.09g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

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