Name: Name:5H-1-Benzazepin-5-one, 1-(4-amino-2-methylbenzoyl)-7-chloro-1,2,3,4-tetrahydro-
Brand: Angene
SKU: AG0017RY
Rating: 90 (10 reviews)

5H-1-Benzazepin-5-one, 1-(4-amino-2-methylbenzoyl)-7-chloro-1,2,3,4-tetrahydro-

CAS No.:

137977-97-0

Catalog Number:

AG0017RY

Molecular Formula:

C18H17ClN2O2

Molecular Weight:

328.7928

Catalog Number:

AG0017RY

Chemical Name:

5H-1-Benzazepin-5-one, 1-(4-amino-2-methylbenzoyl)-7-chloro-1,2,3,4-tetrahydro-

CAS Number:

137977-97-0

Molecular Formula:

C18H17ClN2O2

Molecular Weight:

328.7928

MDL Number:

MFCD19440799

IUPAC Name:

1-(4-amino-2-methylbenzoyl)-7-chloro-3,4-dihydro-2H-1-benzazepin-5-one

InChI:

InChI=1S/C18H17ClN2O2/c1-11-9-13(20)5-6-14(11)18(23)21-8-2-3-17(22)15-10-12(19)4-7-16(15)21/h4-7,9-10H,2-3,8,20H2,1H3

InChI Key:

FLJCJPKXJWRZJB-UHFFFAOYSA-N

SMILES:

Nc1ccc(c(c1)C)C(=O)N1CCCC(=O)c2c1ccc(c2)Cl

Complexity:

470

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

328.098g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

328.796g/mol

Monoisotopic Mass:

328.098g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1