1,3-dimethyl-8-(morpholin-4-yl)-7-(3-{[(morpholin-4-yl)methylidene]amino}propyl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
1,3-dimethyl-8-(morpholin-4-yl)-7-(3-{[(morpholin-4-yl)methylidene]amino}propyl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
1,3-dimethyl-8-(morpholin-4-yl)-7-(3-{[(morpholin-4-yl)methylidene]amino}propyl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8012-2310 |
| Compound Name: | 1,3-dimethyl-8-(morpholin-4-yl)-7-(3-{[(morpholin-4-yl)methylidene]amino}propyl)-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C19 H29 N7 O4 |
| Salt: | HCl |
| Smiles: | CN1C(c2c(nc(N3CCOCC3)n2CCC/N=C/N2CCOCC2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4196 |
| logD: | 0.3938 |
| logSw: | -0.4514 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.231 |
| InChI Key: | NEPZBKWXFNKJMO-XSFVSMFZSA-N |