ethyl 1-{[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperidine-4-carboxylate
ethyl 1-{[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C138-1145 |
| Compound Name: | ethyl 1-{[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperidine-4-carboxylate |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C22 H31 N5 O6 S2 |
| Smiles: | CCOC(C1CCN(CC1)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(C)CC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0351 |
| logD: | -0.0978 |
| logSw: | -1.3296 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 98.575 |
| InChI Key: | ZOVWTYHVMQIGTP-UHFFFAOYSA-N |