1-[6-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]-N-methylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-[6-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]-N-methylpiperidine-4-carboxamide
1-[6-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]-N-methylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | L865-1611 |
| Compound Name: | 1-[6-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]-N-methylpiperidine-4-carboxamide |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C22 H30 N6 O3 S |
| Smiles: | CNC(C1CCN(CC1)c1nc2c(C(N(CC(NCCC3CCCCC=3)=O)C=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.316 |
| logD: | 1.316 |
| logSw: | -1.989 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.528 |
| InChI Key: | DEMAPUFJHBFIFH-UHFFFAOYSA-N |