ethyl 4-{[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperazine-1-carboxylate
ethyl 4-{[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C096-0221 |
| Compound Name: | ethyl 4-{[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}piperazine-1-carboxylate |
| Molecular Weight: | 511.62 |
| Molecular Formula: | C21 H29 N5 O6 S2 |
| Smiles: | CCOC(N1CCN(CC1)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6857 |
| logD: | 0.6857 |
| logSw: | -1.6575 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.125 |
| InChI Key: | BTHMKAHCTDVTLS-UHFFFAOYSA-N |