N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
Compound characteristics
| Compound ID: | V005-9276 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea |
| Molecular Weight: | 554.69 |
| Molecular Formula: | C29 H42 N6 O5 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CCN1CCOCC1)CC(N1C(CC(c2cccn2C)=N1)c1cc(ccc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7534 |
| logD: | 3.0027 |
| logSw: | -3.9394 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.497 |
| InChI Key: | AJPCZWQZXIEWMQ-VWLOTQADSA-N |