N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3-fluorobenzamide
N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | L088-0389 |
| Compound Name: | N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-3-fluorobenzamide |
| Molecular Weight: | 389.86 |
| Molecular Formula: | C20 H21 Cl F N3 O2 |
| Smiles: | Cc1c(cccc1[Cl])/N=C(\NCC1CCCO1)NC(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9474 |
| logD: | 3.8977 |
| logSw: | -4.3108 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.808 |
| InChI Key: | JSOXNSJLSUANAK-MRXNPFEDSA-N |