methyl 5-{[1-(cyclopropylmethyl)-3-(3-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[1-(cyclopropylmethyl)-3-(3-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
methyl 5-{[1-(cyclopropylmethyl)-3-(3-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | V021-8323 |
| Compound Name: | methyl 5-{[1-(cyclopropylmethyl)-3-(3-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C23 H22 N4 O6 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(Cn2cnc3c2C(N(CC2CC2)C(N3c2cccc(c2)OC)=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7417 |
| logD: | 2.7417 |
| logSw: | -2.9366 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.357 |
| InChI Key: | BQBVDWQXCWCZDI-UHFFFAOYSA-N |