AG000X80

1276110-06-5 | Imidazo[1,2-a]pyridine-3-carboxylic acid, 6-[5-[(phenylsulfonyl)amino]-3-pyridinyl]-, ethyl ester

AG000X80

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CAS Number	1276110-06-5
Catalog Number	AG000X80(AGN-PC-0WCRFD)
Chemical Name	Imidazo[1,2-a]pyridine-3-carboxylic acid, 6-[5-[(phenylsulfonyl)amino]-3-pyridinyl]-, ethyl ester
IUPAC Name	ethyl 6-[5-(benzenesulfonamido)pyridin-3-yl]imidazo[1,2-a]pyridine-3-carboxylate
InChI	InChI=1S/C21H18N4O4S/c1-2-29-21(26)19-13-23-20-9-8-15(14-25(19)20)16-10-17(12-22-11-16)24-30(27,28)18-6-4-3-5-7-18/h3-14,24H,2H2,1H3
InChI Key	SEKOTFCHZNXZMM-UHFFFAOYSA-N
MDL Number	MFCD28023584
Molecular Formula	C21H18N4O4S
Molecular Weight	422.4570
SMILES	C1(=CC=CC=C1)S(=O)(=O)NC=1C=C(C=NC1)C=1C=CC=2N(C1)C(=CN2)C(=O)OCC
Synonyms	ethyl 6-(5-(phenylsulfonamido)pyridin-3-yl)imidazo(1,2-a)pyridine-3-carboxylate, HS-173, HS-173, 1276110-06-5, Ethyl 6-(5-(phenylsulfonamido)pyridin-3-yl)imidazo[1,2-a]pyridine-3-carboxylate, CHEMBL1765463, HS 173, GTPL8243, SCHEMBL20768095, AOB6845, EX-A320, HMS3653I16, HS173, BCP09225, 2465AH, BDBM50341493, MFCD28023584, s7356, ZINC71319188, AKOS026750419, ACN-053037, CS-6015, SB19242, NCGC00386329-02, AK474032, BC600371, HY-15868, FT-0700155, SW219873-1, J3.560.887G, A13021, J-690118, Ethyl 6-(5-(Phenylsulfonamido)pyridin-3-yl)imidazo[1,2-a]-pyridine-3-carboxylate, ethyl 6-[5-(benzenesulfonamido)pyridin-3-yl]imidazo[1,2-a]pyridine-3-carboxylate, CHEMBL1765463|||Ethyl 6-[5-(benzenesulfonamido)pyridin-3-yl]imidazo[1,2-a]pyridine-3-carboxylate, Imidazo[1,2-a]pyridine-3-carboxylic acid, 6-[5-[(phenylsulfonyl)amino]-3-pyridinyl]-, ethyl ester, Altiratinib, D0R2UG, C21H18N4O4S, B4492,

Complexity	692
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	422.105g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	422.459g/mol
Monoisotopic Mass	422.105g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	111A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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