ethyl (1-{[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxo-2-phenylethyl)carbamate
Chemical Structure Depiction of
ethyl (1-{[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxo-2-phenylethyl)carbamate
ethyl (1-{[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxo-2-phenylethyl)carbamate
Compound characteristics
Compound ID: | Y070-0868 |
Compound Name: | ethyl (1-{[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxo-2-phenylethyl)carbamate |
Molecular Weight: | 429.54 |
Molecular Formula: | C22 H27 N3 O4 S |
Smiles: | CCNC(c1c2CCCCc2sc1NC(C(c1ccccc1)=O)NC(=O)OCC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3045 |
logD: | 3.3045 |
logSw: | -3.682 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 79.295 |
InChI Key: | AXMNZUNSBZUWMT-LJQANCHMSA-N |