N'-ethyl-N-(3-methoxypropyl)-N-{[3-(3-methylphenyl)-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}thiourea
Chemical Structure Depiction of
N'-ethyl-N-(3-methoxypropyl)-N-{[3-(3-methylphenyl)-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}thiourea
N'-ethyl-N-(3-methoxypropyl)-N-{[3-(3-methylphenyl)-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}thiourea
Compound characteristics
| Compound ID: | V031-0428 |
| Compound Name: | N'-ethyl-N-(3-methoxypropyl)-N-{[3-(3-methylphenyl)-5-(pyrrolidin-1-yl)-1,2-oxazol-4-yl]methyl}thiourea |
| Molecular Weight: | 416.58 |
| Molecular Formula: | C22 H32 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCNC(N(CCCOC)Cc1c(c2cccc(C)c2)noc1N1CCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.1803 |
| logD: | 4.1803 |
| logSw: | -4.1963 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.904 |
| InChI Key: | NBHURMIPIRQKOE-UHFFFAOYSA-N |