2-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-[(pyridin-3-yl)methyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-[(pyridin-3-yl)methyl]-1,3-thiazole-4-carboxamide
2-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-[(pyridin-3-yl)methyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V006-7641 |
| Compound Name: | 2-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-[(pyridin-3-yl)methyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C23 H24 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(Cc1nc(cs1)C(NCc1cccnc1)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2175 |
| logD: | 3.2174 |
| logSw: | -3.2781 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.5 |
| InChI Key: | IZWXNVIIBPWLSF-UHFFFAOYSA-N |