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

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

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

CAS No:
845630-87-7
Formula:
C20H23ClN4OS
Chemical Name:
4-(3-chlorophenyl)-11-methyl-5-(2-methylpropylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
STK585030;ZINC20358843;AKOS005508432;MCULE-6186171194;3-(3-chlorophenyl)-7-methyl-2-[(2-methylpropyl)amino]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;845630-87-7

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

Molecular Weight：

402.9 g/mol

Exact Mass：

402.1281102 g/mol

Characteristics

PSA：

76.2 Å²

Computed Properties

Molecular Weight:402.9
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:402.1281102
Monoisotopic Mass:402.1281102
Topological Polar Surface Area:76.2
Heavy Atom Count:27
Complexity:601
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-chlorophenyl)-11-methyl-5-(2-methylpropylamino)-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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