 Home > Encyclopedia > N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine

N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine

N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine structure

CAS No:
742116-41-2
Formula:
C22H27BrN4S2
Chemical Name:
N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine
Synonyms:
ZINC3314902;AKOS034155113;MCULE-5166078323;AB00722985-01;AB00722985-02;Z31223254;5-{[(4-bromophenyl)sulfanyl]methyl}-N-[3-(dimethylamino)propyl]-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraen-3-amine;742116-41-2

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N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine Basic Attributes

Molecular Weight：

491.5 g/mol

Exact Mass：

490.08605 g/mol

Characteristics

PSA：

94.6 Å²

Computed Properties

Molecular Weight:491.5
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:490.08605
Monoisotopic Mass:490.08605
Topological Polar Surface Area:94.6
Heavy Atom Count:29
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[2-[(4-bromophenyl)sulfanylmethyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine

Basic Attributes
Characteristics
Computed Properties

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