AC1LQ1PW structure

AC1LQ1PW

2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Also Known As: SR-01000258762-1|2-{[(2E)-3-(4-METHOXYPHENYL)-2-PROPENOYL]AMINO}-N-(3-PYRIDINYLMETHYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE|2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|2-{[3-(4-methoxyphenyl)acryloyl]amino}-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|2-(((2E)-3-(4-METHOXYPHENYL)-2-PROPENOYL)AMINO)-N-(3-PYRIDINYLMETHYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE|2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|646-087-4

CAS: 609796-19-2
Molecular Formula C25H25N3O3S
Molecular Weight 447.16165 g/mol
LogP 4.6124
Topological Polar Surface Area 80.32 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 447.16165
Monoisotopic Mass 447.16165
Heavy Atoms 32
Complexity 1121.3389

Chemical Identifiers

CAS Number 609796-19-2
SMILES COC1=CC=C(C=C1)/C=C/C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CN=CC=C4

Product Overview

AC1LQ1PW (CAS 609796-19-2), with molecular formula C25H25N3O3S and molecular weight 447.16165 g/mol. IUPAC: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.

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