methyl 2-{2-[(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4-phenylthiophene-3-carboxylate
methyl 2-{2-[(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4112-4325 |
| Compound Name: | methyl 2-{2-[(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C23 H19 N3 O3 S3 |
| Smiles: | COC(c1c(csc1NC(CSc1c2c3CCCc3sc2ncn1)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1493 |
| logD: | 5.1371 |
| logSw: | -5.28 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.146 |
| InChI Key: | WUFLXODNIXFMAH-UHFFFAOYSA-N |