methyl 4-({3-[(methanesulfonyl)(oxan-4-yl)amino]azetidine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({3-[(methanesulfonyl)(oxan-4-yl)amino]azetidine-1-carbonyl}amino)benzoate
methyl 4-({3-[(methanesulfonyl)(oxan-4-yl)amino]azetidine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | S591-0886 |
| Compound Name: | methyl 4-({3-[(methanesulfonyl)(oxan-4-yl)amino]azetidine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C18 H25 N3 O6 S |
| Smiles: | COC(c1ccc(cc1)NC(N1CC(C1)N(C1CCOCC1)S(C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3219 |
| logD: | 1.3219 |
| logSw: | -2.2494 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.338 |
| InChI Key: | GYEVLYFXNTYACC-UHFFFAOYSA-N |