N-(2-methoxyphenyl)-N'-(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)thiourea
Chemical Structure Depiction of
N-(2-methoxyphenyl)-N'-(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)thiourea
N-(2-methoxyphenyl)-N'-(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)thiourea
Compound characteristics
| Compound ID: | 4830-0336 |
| Compound Name: | N-(2-methoxyphenyl)-N'-(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)thiourea |
| Molecular Weight: | 319.43 |
| Molecular Formula: | C15 H21 N5 O S |
| Smiles: | COc1ccccc1NC(NC12CN3CN(C1)CN(C2)C3)=S |
| Stereo: | ACHIRAL |
| logP: | 1.7681 |
| logD: | 1.5522 |
| logSw: | -2.2713 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.769 |
| InChI Key: | XFMKOOBWYMYMTB-UHFFFAOYSA-N |