N-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}-N'-(3,4,5-trimethoxyphenyl)urea
Chemical Structure Depiction of
N-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}-N'-(3,4,5-trimethoxyphenyl)urea
N-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}-N'-(3,4,5-trimethoxyphenyl)urea
Compound characteristics
| Compound ID: | G373-3495 |
| Compound Name: | N-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}-N'-(3,4,5-trimethoxyphenyl)urea |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C24 H30 N6 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(NCCn1c2ccc(cc2nn1)C(N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5399 |
| logD: | 1.5398 |
| logSw: | -2.1583 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.007 |
| InChI Key: | QQNRFFWGNBNARA-UHFFFAOYSA-N |