N-{N'-(3-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
N-{N'-(3-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | L089-1334 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 475.34 |
| Molecular Formula: | C21 H23 Br N4 O4 |
| Smiles: | C(CN1CCOCC1)N\C(NC(c1ccc2c(c1)OCO2)=O)=N/c1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.1122 |
| logD: | 1.9676 |
| logSw: | -3.2787 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.699 |
| InChI Key: | HPTHQPLALQFFQP-UHFFFAOYSA-N |