methyl 2-{[(pyridin-4-yl)methyl]carbamamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[(pyridin-4-yl)methyl]carbamamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-{[(pyridin-4-yl)methyl]carbamamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8020-0493 |
| Compound Name: | methyl 2-{[(pyridin-4-yl)methyl]carbamamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 331.39 |
| Molecular Formula: | C16 H17 N3 O3 S |
| Smiles: | COC(c1c2CCCc2sc1NC(NCc1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7673 |
| logD: | 0.8947 |
| logSw: | -2.1924 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.547 |
| InChI Key: | KXYUFPVEFAJJMY-UHFFFAOYSA-N |