 Home > Encyclopedia > 4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
844833-71-2
Formula:
C21H26ClN5OS
Chemical Name:
4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
C21H26ClN5OS;ZINC2410275;STK595605;AKOS005516881;MCULE-2199138267;3-(3-chlorophenyl)-2-{[3-(dimethylamino)propyl]amino}-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;844833-71-2

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4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

432.0 g/mol

Exact Mass：

431.1546593 g/mol

Characteristics

PSA：

79.4 Å²

Computed Properties

Molecular Weight:432.0
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:431.1546593
Monoisotopic Mass:431.1546593
Topological Polar Surface Area:79.4
Heavy Atom Count:29
Complexity:632
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-chlorophenyl)-5-[3-(dimethylamino)propylamino]-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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