N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide
N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide
Compound characteristics
| Compound ID: | C069-0719 |
| Compound Name: | N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide |
| Molecular Weight: | 398.36 |
| Molecular Formula: | C17 H24 Br N3 O S |
| Smiles: | CC1CC(C)(C)NC(N1CCCC(Nc1ccc(cc1)[Br])=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2228 |
| logD: | 3.2226 |
| logSw: | -3.5047 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.125 |
| InChI Key: | ZZUHCKPTKSKMET-LBPRGKRZSA-N |