 Home > Encyclopedia > N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine

N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine

N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine structure

CAS No:
732987-02-9
Formula:
C20H22ClN3S2
Chemical Name:
N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
Synonyms:
ZINC3304533;AKOS034154848;MCULE-1063987127;Z31215069;732987-02-9;N-butyl-10-{[(4-chlorophenyl)sulfanyl]methyl}-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-amine

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N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine Basic Attributes

Molecular Weight：

404.0 g/mol

Exact Mass：

403.0943678 g/mol

Characteristics

PSA：

91.4 Å²

Computed Properties

Molecular Weight:404.0
XLogP3:6.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:403.0943678
Monoisotopic Mass:403.0943678
Topological Polar Surface Area:91.4
Heavy Atom Count:26
Complexity:447
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-butyl-10-[(4-chlorophenyl)sulfanylmethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine

Basic Attributes
Characteristics
Computed Properties

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