 Home > Encyclopedia > N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure

CAS No:
379728-65-1
Formula:
C27H31N5OS
Chemical Name:
N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Synonyms:
Oprea1_610036;ZINC3227221;AKOS034458570;MCULE-2388399658;Z56827565;379728-65-1;N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide

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N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes

Molecular Weight：

473.6 g/mol

Exact Mass：

473.22493180 g/mol

Characteristics

PSA：

78.8 Å²

Computed Properties

Molecular Weight:473.6
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:473.22493180
Monoisotopic Mass:473.22493180
Topological Polar Surface Area:78.8
Heavy Atom Count:34
Complexity:665
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[2-(dimethylamino)ethyl]-2-(phenoxymethyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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