Name: Name:1-{4-[(3-acetyl-5-chloro-2-hydroxyphenyl)methyl]piperazin-1-yl}ethan-1-one
Brand: Angene
SKU: AG01A897
Rating: 90 (10 reviews)

1-{4-[(3-acetyl-5-chloro-2-hydroxyphenyl)methyl]piperazin-1-yl}ethan-1-one

CAS No.:

1157885-84-1

Catalog Number:

AG01A897

Molecular Formula:

C15H19ClN2O3

Molecular Weight:

310.7760

Catalog Number:

AG01A897

Chemical Name:

1-{4-[(3-acetyl-5-chloro-2-hydroxyphenyl)methyl]piperazin-1-yl}ethan-1-one

CAS Number:

1157885-84-1

Molecular Formula:

C15H19ClN2O3

Molecular Weight:

310.7760

MDL Number:

MFCD13802130

IUPAC Name:

1-[3-[(4-acetylpiperazin-1-yl)methyl]-5-chloro-2-hydroxyphenyl]ethanone

InChI:

InChI=1S/C15H19ClN2O3/c1-10(19)14-8-13(16)7-12(15(14)21)9-17-3-5-18(6-4-17)11(2)20/h7-8,21H,3-6,9H2,1-2H3

InChI Key:

IYFDKERIFJQVLO-UHFFFAOYSA-N

SMILES:

Clc1cc(CN2CCN(CC2)C(=O)C)c(c(c1)C(=O)C)O

Complexity:

396

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

310.108g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

310.778g/mol

Monoisotopic Mass:

310.108g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5