N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(propan-2-yl)phenyl]thiourea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(propan-2-yl)phenyl]thiourea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(propan-2-yl)phenyl]thiourea
Compound characteristics
| Compound ID: | 8015-4185 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[4-(propan-2-yl)phenyl]thiourea |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C18 H20 N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(NCc1ccc2c(c1)OCO2)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4066 |
| logD: | 4.4066 |
| logSw: | -4.3124 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.499 |
| InChI Key: | DIHAIQMNURSQGG-UHFFFAOYSA-N |