5-tert-butyl-3-[1-(2-chloropyridine-4-carbonyl)piperidin-4-yl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-tert-butyl-3-[1-(2-chloropyridine-4-carbonyl)piperidin-4-yl]-1,3-benzoxazol-2(3H)-one
5-tert-butyl-3-[1-(2-chloropyridine-4-carbonyl)piperidin-4-yl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | V019-1852 |
| Compound Name: | 5-tert-butyl-3-[1-(2-chloropyridine-4-carbonyl)piperidin-4-yl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(C1CCN(CC1)C(c1ccnc(c1)[Cl])=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.9508 |
| logD: | 3.9508 |
| logSw: | -4.4684 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.66 |
| InChI Key: | POALIVXLJUGRDB-UHFFFAOYSA-N |