 Home > Encyclopedia > N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide

N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide

N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide structure

CAS No:
850752-44-2
Formula:
C18H17ClN4O3S
Chemical Name:
N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide
Synonyms:
ZINC2423288;STL232189;AKOS025272562;MCULE-1331632481;850752-44-2;N-(3-chlorophenyl)-2-(6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-3(6H)-yl)acetamide

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N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide Basic Attributes

Molecular Weight：

404.9 g/mol

Exact Mass：

404.0709893 g/mol

Characteristics

PSA：

112 Å²

Computed Properties

Molecular Weight:404.9
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:404.0709893
Monoisotopic Mass:404.0709893
Topological Polar Surface Area:112
Heavy Atom Count:27
Complexity:646
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(3-chlorophenyl)-2-(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,5,6-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)acetamide

Basic Attributes
Characteristics
Computed Properties

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