5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[3-(4-propylpiperazin-1-yl)propyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[3-(4-propylpiperazin-1-yl)propyl]furan-2-carboxamide
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[3-(4-propylpiperazin-1-yl)propyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-2508 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[3-(4-propylpiperazin-1-yl)propyl]furan-2-carboxamide |
| Molecular Weight: | 496.47 |
| Molecular Formula: | C22 H30 Br N3 O3 S |
| Smiles: | CCCN1CCN(CCCNC(c2ccc(CS(c3ccc(cc3)[Br])=O)o2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.0461 |
| logD: | 2.0813 |
| logSw: | -3.3917 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.248 |
| InChI Key: | BACTYXMHKXGLFG-UHFFFAOYSA-N |