methyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)-4-methylbenzoate
Chemical Structure Depiction of
methyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)-4-methylbenzoate
methyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)-4-methylbenzoate
Compound characteristics
| Compound ID: | F874-0807 |
| Compound Name: | methyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)-4-methylbenzoate |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C22 H23 Cl N4 O4 |
| Smiles: | Cc1ccc(C(=O)OC)c(c1)NC(N1CCN(CC1)Cc1nc2cc(ccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6061 |
| logD: | 3.5962 |
| logSw: | -3.8662 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.471 |
| InChI Key: | UHCDCOJMVUKQHR-UHFFFAOYSA-N |