Name: Name:4H-Imidazo[1,5-a][1,4]benzodiazepine-3-carboxylicacid, 5,6-dihydro-8-hydroxy-5-methyl-6-oxo-, ethyl ester
Brand: Angene
SKU: AG009FPN
Rating: 90 (10 reviews)

4H-Imidazo[1,5-a][1,4]benzodiazepine-3-carboxylicacid, 5,6-dihydro-8-hydroxy-5-methyl-6-oxo-, ethyl ester

CAS No.:

131666-45-0

Catalog Number:

AG009FPN

Molecular Formula:

C15H15N3O4

Molecular Weight:

301.2973

Catalog Number:

AG009FPN

Chemical Name:

4H-Imidazo[1,5-a][1,4]benzodiazepine-3-carboxylicacid, 5,6-dihydro-8-hydroxy-5-methyl-6-oxo-, ethyl ester

CAS Number:

131666-45-0

Molecular Formula:

C15H15N3O4

Molecular Weight:

301.2973

MDL Number:

MFCD27665527

IUPAC Name:

ethyl 8-hydroxy-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

InChI:

InChI=1S/C15H15N3O4/c1-3-22-15(21)13-12-7-17(2)14(20)10-6-9(19)4-5-11(10)18(12)8-16-13/h4-6,8,19H,3,7H2,1-2H3

InChI Key:

PCCARNSSXAGDHQ-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)O

Complexity:

458

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.302g/mol

Monoisotopic Mass:

301.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5