 Home > Encyclopedia > N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide structure

CAS No:
736936-11-1
Formula:
C22H22N4O3
Chemical Name:
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Synonyms:
ZINC3297665;AKOS000932189;MCULE-1916758176;Z27146326;736936-11-1;N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

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N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Basic Attributes

Molecular Weight：

390.4 g/mol

Exact Mass：

390.16919058 g/mol

Characteristics

PSA：

78.3 Å²

Computed Properties

Molecular Weight:390.4
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:390.16919058
Monoisotopic Mass:390.16919058
Topological Polar Surface Area:78.3
Heavy Atom Count:29
Complexity:568
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Basic Attributes
Characteristics
Computed Properties

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