Name: Name:4-[({1-[(4-bromophenyl)methyl]piperidin-4-yl}carbamoyl)methoxy]benzamide
Brand: Angene
SKU: AG01ALYY
Rating: 90 (10 reviews)

4-[({1-[(4-bromophenyl)methyl]piperidin-4-yl}carbamoyl)methoxy]benzamide

CAS No.:

1427986-92-2

Catalog Number:

AG01ALYY

Molecular Formula:

C21H24BrN3O3

Molecular Weight:

446.3376

Catalog Number:

AG01ALYY

Chemical Name:

4-[({1-[(4-bromophenyl)methyl]piperidin-4-yl}carbamoyl)methoxy]benzamide

CAS Number:

1427986-92-2

Molecular Formula:

C21H24BrN3O3

Molecular Weight:

446.3376

MDL Number:

MFCD28968305

IUPAC Name:

4-[2-[[1-[(4-bromophenyl)methyl]piperidin-4-yl]amino]-2-oxoethoxy]benzamide

InChI:

InChI=1S/C21H24BrN3O3/c22-17-5-1-15(2-6-17)13-25-11-9-18(10-12-25)24-20(26)14-28-19-7-3-16(4-8-19)21(23)27/h1-8,18H,9-14H2,(H2,23,27)(H,24,26)

InChI Key:

CVJYDLCZCAYBNP-UHFFFAOYSA-N

SMILES:

O=C(NC1CCN(CC1)Cc1ccc(cc1)Br)COc1ccc(cc1)C(=O)N

Complexity:

509

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

445.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

446.345g/mol

Monoisotopic Mass:

445.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9