N-cyclopropyl-1-{6-[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-{6-[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
N-cyclopropyl-1-{6-[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1675 |
| Compound Name: | N-cyclopropyl-1-{6-[(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C23 H29 N5 O3 S |
| Smiles: | COc1ccc(CNC(CSc2cc(ncn2)N2CCC(CC2)C(NC2CC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6189 |
| logD: | 2.6189 |
| logSw: | -2.9894 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.539 |
| InChI Key: | ZGESIQWOPNHOOW-UHFFFAOYSA-N |