ethyl 3-({[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}carbamamido)-3-phenylpropanoate
Chemical Structure Depiction of
ethyl 3-({[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}carbamamido)-3-phenylpropanoate
ethyl 3-({[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}carbamamido)-3-phenylpropanoate
Compound characteristics
| Compound ID: | E635-0060 |
| Compound Name: | ethyl 3-({[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}carbamamido)-3-phenylpropanoate |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C25 H30 N4 O3 S |
| Smiles: | CCOC(CC(c1ccccc1)NC(NCc1c2CCN(C)Cc2sc1n1cccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7618 |
| logD: | 1.9979 |
| logSw: | -3.8853 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.36 |
| InChI Key: | KICMENUSDUUSDA-NRFANRHFSA-N |