methyl 2-[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-1,2-dihydro-1,2,3,4-tetrazine-5-carboxylate
Chemical Structure Depiction of
methyl 2-[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-1,2-dihydro-1,2,3,4-tetrazine-5-carboxylate
methyl 2-[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-1,2-dihydro-1,2,3,4-tetrazine-5-carboxylate
Compound characteristics
| Compound ID: | 8017-6339 |
| Compound Name: | methyl 2-[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-1,2-dihydro-1,2,3,4-tetrazine-5-carboxylate |
| Molecular Weight: | 307.31 |
| Molecular Formula: | C11 H17 N9 O2 |
| Smiles: | CCN(CC)c1nc(N)nc(n1)N1NC=C(C(=O)OC)N=N1 |
| Stereo: | ACHIRAL |
| logP: | 2.1377 |
| logD: | 2.1377 |
| logSw: | -2.2758 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.426 |
| InChI Key: | BVBMHJSQITXENE-UHFFFAOYSA-N |