 Home > Encyclopedia > 4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one structure

CAS No:
351004-88-1
Formula:
C23H25ClN2O2S2
Chemical Name:
4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Synonyms:
Oprea1_664200;ZINC2277238;STK722400;AKOS005530739;MCULE-7905363184;3-butyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;351004-88-1

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4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

461.0 g/mol

Exact Mass：

460.1045981 g/mol

Characteristics

PSA：

103 Å²

Computed Properties

Molecular Weight:461.0
XLogP3:6.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:460.1045981
Monoisotopic Mass:460.1045981
Topological Polar Surface Area:103
Heavy Atom Count:30
Complexity:666
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-butyl-5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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