N-{N'-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{N'-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
N-{N'-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | L089-0620 |
| Compound Name: | N-{N'-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 430.89 |
| Molecular Formula: | C21 H23 Cl N4 O4 |
| Smiles: | C(CN1CCOCC1)N\C(NC(c1ccc2c(c1)OCO2)=O)=N/c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9581 |
| logD: | 1.8135 |
| logSw: | -3.5935 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.699 |
| InChI Key: | YZUHWPUGSUQVFG-UHFFFAOYSA-N |