2-[(5-bromo-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(5-bromo-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one
2-[(5-bromo-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 5803-0010 |
| Compound Name: | 2-[(5-bromo-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(3-hydroxypropyl)quinazolin-4(3H)-one |
| Molecular Weight: | 454.32 |
| Molecular Formula: | C22 H20 Br N3 O3 |
| Smiles: | CCN1C(C(=C/C2=Nc3ccccc3C(N2CCCO)=O)\c2cc(ccc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8429 |
| logD: | 2.8429 |
| logSw: | -3.4233 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.576 |
| InChI Key: | YNMHRBKTIQMAPO-UHFFFAOYSA-N |