Name: Name:6-Chloro-2,3,4,5-tetrahydro-7,8-dimethoxy-1-(4-methoxyphenyl)-1H-3-benzazepine
Brand: Angene
SKU: AG0038I1
Rating: 90 (10 reviews)

6-Chloro-2,3,4,5-tetrahydro-7,8-dimethoxy-1-(4-methoxyphenyl)-1H-3-benzazepine

CAS No.:

67287-53-0

Catalog Number:

AG0038I1

Molecular Formula:

C19H22ClNO3

Molecular Weight:

347.8359

Catalog Number:

AG0038I1

Chemical Name:

6-Chloro-2,3,4,5-tetrahydro-7,8-dimethoxy-1-(4-methoxyphenyl)-1H-3-benzazepine

CAS Number:

67287-53-0

Molecular Formula:

C19H22ClNO3

Molecular Weight:

347.8359

MDL Number:

MFCD08460175

IUPAC Name:

9-chloro-7,8-dimethoxy-5-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine

InChI:

InChI=1S/C19H22ClNO3/c1-22-13-6-4-12(5-7-13)16-11-21-9-8-14-15(16)10-17(23-2)19(24-3)18(14)20/h4-7,10,16,21H,8-9,11H2,1-3H3

InChI Key:

MYTZRTXHMVXREA-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)C1CNCCc2c1cc(OC)c(c2Cl)OC

EC Number:

266-633-1

Complexity:

389

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

347.129g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

347.839g/mol

Monoisotopic Mass:

347.129g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4