AC1NLWFB structure

AC1NLWFB

2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Also Known As: UPCMLD0ENAT5890025:001|F3394-1148|5-{[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-11-methyl-4-(prop-2-en-1-yl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|3-allyl-2-((2-(3,4-dimethylphenyl)-2-oxoethyl)thio)-7-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one

CAS: 690646-28-7
Molecular Formula C24H26N2O2S2
Molecular Weight 438.1436 g/mol
LogP 5.36064
Topological Polar Surface Area 51.96 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 438.1436
Monoisotopic Mass 438.1436
Heavy Atoms 30
Complexity 1206.1168

Chemical Identifiers

CAS Number 690646-28-7
SMILES CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC(=C(C=C4)C)C)CC=C

Product Overview

AC1NLWFB (CAS 690646-28-7), with molecular formula C24H26N2O2S2 and molecular weight 438.1436 g/mol. IUPAC: 2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.

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