AC1MPQYT structure

AC1MPQYT

2-[(12-ethyl-12-methyl-3-oxo-4-prop-2-enyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide

Also Known As: 2-((3-allyl-6-ethyl-6-methyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide|2-{[6-ethyl-6-methyl-4-oxo-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

CAS: 370076-91-8
Molecular Formula C17H21N3O3S2
Molecular Weight 379.10245 g/mol
LogP 2.4628
Topological Polar Surface Area 87.21 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 379.10245
Monoisotopic Mass 379.10245
Heavy Atoms 25
Complexity 902.65564

Chemical Identifiers

CAS Number 370076-91-8
SMILES CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)N)CC=C)C

Product Overview

AC1MPQYT (CAS 370076-91-8), with molecular formula C17H21N3O3S2 and molecular weight 379.10245 g/mol. IUPAC: 2-[(12-ethyl-12-methyl-3-oxo-4-prop-2-enyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide.

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