Name: Name:4,8-dimethyl-1H,2H,3H,4H,5H-pyrido[2,3-b][1,4]diazepin-2-one
Brand: Angene
SKU: AG01AD4D
Rating: 90 (10 reviews)

4,8-dimethyl-1H,2H,3H,4H,5H-pyrido[2,3-b][1,4]diazepin-2-one

CAS No.:

1522248-97-0

Catalog Number:

AG01AD4D

Molecular Formula:

C10H13N3O

Molecular Weight:

191.2297

Catalog Number:

AG01AD4D

Chemical Name:

4,8-dimethyl-1H,2H,3H,4H,5H-pyrido[2,3-b][1,4]diazepin-2-one

CAS Number:

1522248-97-0

Molecular Formula:

C10H13N3O

Molecular Weight:

191.2297

MDL Number:

MFCD21842239

IUPAC Name:

4,8-dimethyl-1,3,4,5-tetrahydropyrido[2,3-b][1,4]diazepin-2-one

InChI:

InChI=1S/C10H13N3O/c1-6-3-8-10(11-5-6)12-7(2)4-9(14)13-8/h3,5,7H,4H2,1-2H3,(H,11,12)(H,13,14)

InChI Key:

XCJLRWAPEUWDTK-UHFFFAOYSA-N

SMILES:

CC1CC(=O)Nc2c(N1)ncc(c2)C

Complexity:

231

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.234g/mol

Monoisotopic Mass:

191.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9