[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2,6-dichlorobenzoate
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[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2,6-dichlorobenzoate
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CAS No:
733006-61-6
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Formula:
C19H16Cl2N2O3S
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Chemical Name:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2,6-dichlorobenzoate
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Synonyms:
ZINC3313101;AKOS033616907;MCULE-3914420631;Z18401650;({3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}carbamoyl)methyl 2,6-dichlorobenzoate;733006-61-6
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CAS No:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2,6-dichlorobenzoate Basic Attributes
423.3 g/mol
422.0258689 g/mol
Computed Properties
Molecular Weight:423.3
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:422.0258689
Monoisotopic Mass:422.0258689
Topological Polar Surface Area:107
Heavy Atom Count:27
Complexity:601
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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