N-{4-(dimethylamino)-3-[(3-methoxypropyl)carbamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{4-(dimethylamino)-3-[(3-methoxypropyl)carbamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
N-{4-(dimethylamino)-3-[(3-methoxypropyl)carbamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V012-3960 |
| Compound Name: | N-{4-(dimethylamino)-3-[(3-methoxypropyl)carbamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C21 H25 N3 O5 |
| Salt: | not_available |
| Smiles: | CN(C)c1ccc(cc1C(NCCCOC)=O)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9751 |
| logD: | 2.975 |
| logSw: | -3.5593 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.818 |
| InChI Key: | PPTYGAAVNHIFIK-UHFFFAOYSA-N |