N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)urea
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)urea
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)urea
Compound characteristics
| Compound ID: | 8010-4764 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)urea |
| Molecular Weight: | 401.33 |
| Molecular Formula: | C14 H13 F6 N3 O2 S |
| Smiles: | COC(C(F)(F)F)(C(F)(F)F)NC(Nc1c(C#N)c2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1885 |
| logD: | 4.0005 |
| logSw: | -4.2783 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.08 |
| InChI Key: | ZPZAUSKJJUJPES-UHFFFAOYSA-N |