AC1M5VRP structure

AC1M5VRP

[2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 6-chloropyridine-3-carboxylate

Also Known As: [2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 6-chloropyridine-3-carboxylate|{[3-(methoxycarbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]carbamoyl}methyl 6-chloropyridine-3-carboxylate

CAS: 565192-35-0
Molecular Formula C19H19ClN2O5S
Molecular Weight 422.0703 g/mol
LogP 3.6475
Topological Polar Surface Area 94.59 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 422.0703
Monoisotopic Mass 422.0703
Heavy Atoms 28
Complexity 894.4741

Chemical Identifiers

CAS Number 565192-35-0
SMILES COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)COC(=O)C3=CN=C(C=C3)Cl

Product Overview

AC1M5VRP (CAS 565192-35-0), with molecular formula C19H19ClN2O5S and molecular weight 422.0703 g/mol. IUPAC: [2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 6-chloropyridine-3-carboxylate.

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