 Home > Encyclopedia > N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide

N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide

N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide structure

CAS No:
500276-23-3
Formula:
C27H27N3O2S3
Chemical Name:
N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide
Synonyms:
ZINC1774982;STK543979;AKOS005473147;MCULE-1973812088;500276-23-3;N-benzyl-2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

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N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide Basic Attributes

Molecular Weight：

521.7 g/mol

Exact Mass：

521.12654063 g/mol

Characteristics

PSA：

141 Å²

Computed Properties

Molecular Weight:521.7
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:521.12654063
Monoisotopic Mass:521.12654063
Topological Polar Surface Area:141
Heavy Atom Count:35
Complexity:821
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-benzyl-2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide

Basic Attributes
Characteristics
Computed Properties

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