5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(8-methoxy-4-methylquinazolin-2-yl)-1,3,5-triazinan-2-imine
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(8-methoxy-4-methylquinazolin-2-yl)-1,3,5-triazinan-2-imine
5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(8-methoxy-4-methylquinazolin-2-yl)-1,3,5-triazinan-2-imine
Compound characteristics
| Compound ID: | 8019-5703 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(8-methoxy-4-methylquinazolin-2-yl)-1,3,5-triazinan-2-imine |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C21 H22 N6 O3 |
| Smiles: | Cc1c2cccc(c2nc(N=C2NCN(Cc3ccc4c(c3)OCO4)CN2)n1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.752 |
| logD: | 0.3133 |
| logSw: | -3.209 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.76 |
| InChI Key: | BWKIMEDYSZJFNG-UHFFFAOYSA-N |