3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
Compound ID: | L088-0401 |
Compound Name: | 3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
Molecular Weight: | 442.94 |
Molecular Formula: | C23 H27 Cl N4 O3 |
Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCC1CCCO1)=N/c1cccc(c1C)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9656 |
logD: | 2.9522 |
logSw: | -3.5371 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 72.372 |
InChI Key: | MPNUTASWZDFTCW-GOSISDBHSA-N |