methyl 4-({N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}carbamoyl)benzoate
Chemical Structure Depiction of
methyl 4-({N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}carbamoyl)benzoate
methyl 4-({N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}carbamoyl)benzoate
Compound characteristics
| Compound ID: | L089-1314 |
| Compound Name: | methyl 4-({N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(morpholin-4-yl)ethyl]carbamimidoyl}carbamoyl)benzoate |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C24 H28 N4 O6 |
| Smiles: | COC(c1ccc(cc1)C(NC(/NCCN1CCOCC1)=N/c1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5822 |
| logD: | 0.4376 |
| logSw: | -2.1853 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.581 |
| InChI Key: | CZJJMIZQLOTEGR-UHFFFAOYSA-N |