N-(4-bromo-2-methylphenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide
N-(4-bromo-2-methylphenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide
Compound characteristics
| Compound ID: | C069-0158 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide |
| Molecular Weight: | 398.36 |
| Molecular Formula: | C17 H24 Br N3 O S |
| Smiles: | CC1CC(C)(C)NC(N1CCC(Nc1ccc(cc1C)[Br])=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.623 |
| logD: | 3.6226 |
| logSw: | -3.8603 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.427 |
| InChI Key: | CYRHGAIJICXTAT-LBPRGKRZSA-N |