methyl 4-({N'-(3-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
Chemical Structure Depiction of
methyl 4-({N'-(3-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
methyl 4-({N'-(3-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
Compound characteristics
| Compound ID: | L088-1076 |
| Compound Name: | methyl 4-({N'-(3-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate |
| Molecular Weight: | 399.42 |
| Molecular Formula: | C21 H22 F N3 O4 |
| Smiles: | COC(c1ccc(cc1)C(NC(/NCC1CCCO1)=N/c1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0584 |
| logD: | 3.0516 |
| logSw: | -3.3823 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.679 |
| InChI Key: | AFANCPRRZXMNTB-GOSISDBHSA-N |