5-bromo-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-oxoethyl]-3-hydroxy-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-oxoethyl]-3-hydroxy-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
5-bromo-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-oxoethyl]-3-hydroxy-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | 6540-0351 |
| Compound Name: | 5-bromo-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-2-oxoethyl]-3-hydroxy-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 404.26 |
| Molecular Formula: | C18 H18 Br N3 O3 |
| Smiles: | Cc1c(C(CC2(C(N(CC=C)c3ccc(cc23)[Br])=O)O)=O)c(C)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4725 |
| logD: | 2.4725 |
| logSw: | -2.8098 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.208 |
| InChI Key: | TWLFOXNXCMUULB-SFHVURJKSA-N |