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

CAS No:
845630-69-5
Formula:
C20H21ClN4OS
Chemical Name:
4-(3-chlorophenyl)-11-methyl-5-pyrrolidin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
STK596636;ZINC20358840;AKOS005517926;MCULE-1787053907;3-(3-chlorophenyl)-7-methyl-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;845630-69-5

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

Molecular Weight：

400.9 g/mol

Exact Mass：

400.1124602 g/mol

Characteristics

PSA：

67.4 Å²

Computed Properties

Molecular Weight:400.9
XLogP3:3.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:400.1124602
Monoisotopic Mass:400.1124602
Topological Polar Surface Area:67.4
Heavy Atom Count:27
Complexity:625
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: h2s formula; nitrohydrochloric acid; uranium dioxide; ebastine; 2 pentanol; amphotericin b yellow powder

Guide of 4-(3-chlorophenyl)-11-methyl-5-pyrrolidin-1-yl-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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