N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)urea
Chemical Structure Depiction of
N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)urea
N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)urea
Compound characteristics
| Compound ID: | E002-1816 |
| Compound Name: | N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)urea |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C18 H23 N5 O3 S |
| Smiles: | CN(C1CCCCC1)c1nnc(NC(Nc2ccc3c(c2)OCCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4221 |
| logD: | 3.4221 |
| logSw: | -3.756 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.731 |
| InChI Key: | CBNWAHZWYFOJMV-UHFFFAOYSA-N |