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

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

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

CAS No:
896824-74-1
Formula:
C22H27ClN4OS
Chemical Name:
4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC2214365;STK590093;AKOS005512620;MCULE-4397789791;3-(3-chlorophenyl)-2-{[3-(dimethylamino)propyl]amino}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;896824-74-1

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

Molecular Weight：

431.0 g/mol

Exact Mass：

430.1594104 g/mol

Characteristics

PSA：

76.2 Å²

Computed Properties

Molecular Weight:431.0
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:430.1594104
Monoisotopic Mass:430.1594104
Topological Polar Surface Area:76.2
Heavy Atom Count:29
Complexity:616
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-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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