N'-tert-butyl-N-cyclohexyl-N-[(1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}-1H-pyrrol-2-yl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-cyclohexyl-N-[(1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}-1H-pyrrol-2-yl)methyl]urea
N'-tert-butyl-N-cyclohexyl-N-[(1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}-1H-pyrrol-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V014-9317 |
| Compound Name: | N'-tert-butyl-N-cyclohexyl-N-[(1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}-1H-pyrrol-2-yl)methyl]urea |
| Molecular Weight: | 480.67 |
| Molecular Formula: | C27 H36 N4 O2 S |
| Smiles: | CC(C)(C)NC(N(Cc1cccn1Cc1csc(c2ccc(cc2)OC)n1)C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5386 |
| logD: | 6.5385 |
| logSw: | -5.5201 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.504 |
| InChI Key: | RHHHXMPXUMGPOZ-UHFFFAOYSA-N |