 Home > Encyclopedia > 6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide

6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide

6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide structure

CAS No:
612048-96-1
Formula:
C21H21N3O3S
Chemical Name:
6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide
Synonyms:
Oprea1_686749;ZINC1471220;STK788820;AKOS005611680;MCULE-5237082677;3-amino-N-(1,3-benzodioxol-5-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide;612048-96-1

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6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide Basic Attributes

Molecular Weight：

395.5 g/mol

Exact Mass：

395.13036271 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:395.5
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:395.13036271
Monoisotopic Mass:395.13036271
Topological Polar Surface Area:115
Heavy Atom Count:28
Complexity:579
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-amino-N-(1,3-benzodioxol-5-ylmethyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide

Basic Attributes
Characteristics
Computed Properties

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