Name: Name:(11bS)- N-(2-Benzoyl-4-chlorophenyl)-3,5- 4H-Dinaphth[2,1-c:1',2'-e]azepine-4- acetamide
Brand: Angene
SKU: AG01EUA7
Rating: 90 (10 reviews)

(11bS)- N-(2-Benzoyl-4-chlorophenyl)-3,5- 4H-Dinaphth[2,1-c:1',2'-e]azepine-4- acetamide

CAS No.:

1614264-49-1

Catalog Number:

AG01EUA7

Molecular Formula:

C37H27ClN2O2

Molecular Weight:

567.0755

Catalog Number:

AG01EUA7

Chemical Name:

(11bS)- N-(2-Benzoyl-4-chlorophenyl)-3,5- 4H-Dinaphth[2,1-c:1',2'-e]azepine-4- acetamide

CAS Number:

1614264-49-1

Molecular Formula:

C37H27ClN2O2

Molecular Weight:

567.0755

IUPAC Name:

2-(13-azapentacyclo[13.8.0.02,11.03,8.017,22]tricosa-1(23),2(11),3,5,7,9,15,17,19,21-decaen-13-yl)-N-(2-benzoyl-4-chlorophenyl)acetamide

InChI:

InChI=1S/C37H27ClN2O2/c38-30-16-17-34(33(20-30)37(42)25-9-2-1-3-10-25)39-35(41)23-40-21-28-15-14-24-8-6-7-13-31(24)36(28)32-19-27-12-5-4-11-26(27)18-29(32)22-40/h1-20H,21-23H2,(H,39,41)

InChI Key:

NRNDHJPYVNDJLU-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccc(cc1C(=O)c1ccccc1)Cl)CN1Cc2ccc3c(c2c2c(C1)cc1ccccc1c2)cccc3

Complexity:

950

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

566.176g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

567.085g/mol

Monoisotopic Mass:

566.176g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

8.9