ethyl 1-{5-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{5-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperidine-4-carboxylate
ethyl 1-{5-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V025-7485 |
| Compound Name: | ethyl 1-{5-[({4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C23 H32 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1cc(C)nc(n1)SCc1ccc(C(N2CCC(CC2)C(=O)OCC)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1877 |
| logD: | 4.1855 |
| logSw: | -4.0548 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.978 |
| InChI Key: | RXSHEAKNQZTOCB-UHFFFAOYSA-N |