N-{N'-(3-ethylphenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{N'-(3-ethylphenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
N-{N'-(3-ethylphenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | L089-0657 |
| Compound Name: | N-{N'-(3-ethylphenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C23 H28 N4 O4 |
| Smiles: | CCc1cccc(c1)/N=C(\NCCN1CCOCC1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2075 |
| logD: | 2.0629 |
| logSw: | -3.2978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.699 |
| InChI Key: | PLKKVGOIOWFWQS-UHFFFAOYSA-N |