1-benzyl-3-chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1H-pyrrole-2,5-dione
Chemical Structure Depiction of
1-benzyl-3-chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1H-pyrrole-2,5-dione
1-benzyl-3-chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1H-pyrrole-2,5-dione
Compound characteristics
| Compound ID: | 4491-1428 |
| Compound Name: | 1-benzyl-3-chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1H-pyrrole-2,5-dione |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C21 H21 Cl N2 O4 |
| Smiles: | COc1ccc(CCNC2=C(C(N(Cc3ccccc3)C2=O)=O)[Cl])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5699 |
| logD: | 2.5656 |
| logSw: | -3.4301 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.299 |
| InChI Key: | SSQYJMGGFSLAGR-UHFFFAOYSA-N |