methyl 4-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}benzoate
methyl 4-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D053-0035 |
| Compound Name: | methyl 4-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 369.78 |
| Molecular Formula: | C14 H12 Cl N3 O5 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O)c1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.7607 |
| logD: | 1.3498 |
| logSw: | -2.875 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.665 |
| InChI Key: | FWEMBSJBFIQBDA-UHFFFAOYSA-N |