N-{N'-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{N'-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
N-{N'-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | L089-1159 |
| Compound Name: | N-{N'-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 414.44 |
| Molecular Formula: | C21 H23 F N4 O4 |
| Smiles: | C(CN1CCOCC1)N\C(NC(c1ccc2c(c1)OCO2)=O)=N/c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.1677 |
| logD: | 1.0231 |
| logSw: | -2.9981 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.699 |
| InChI Key: | KXCIDAIVIXUUSN-UHFFFAOYSA-N |