N-tert-butyl-4-(but-2-ynoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide

Chemical Structure Depiction of
N-tert-butyl-4-(but-2-ynoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide
Available: 100 mg
Amount:
mg
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Compound characteristics

Compound ID: T001-0737
Compound Name: N-tert-butyl-4-(but-2-ynoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide
Molecular Weight: 314.38
Molecular Formula: C18 H22 N2 O3
Smiles: CC#CC(N1CCOc2ccccc2C1C(NC(C)(C)C)=O)=O
Stereo: RACEMIC MIXTURE
logP: 3.268
logD: 3.268
logSw: -3.3087
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 47.668
InChI Key: RYKWAGWRQPDGGX-MRXNPFEDSA-N
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