2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-4440 |
| Compound Name: | 2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C28 H36 N4 O5 S |
| Smiles: | CC(C)OCCCNC(c1ccc2C(N(Cc3ccco3)C(=Nc2c1)SCC(NC1CCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2991 |
| logD: | 3.2991 |
| logSw: | -3.7913 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.444 |
| InChI Key: | LIMGAJGJFGLXTM-UHFFFAOYSA-N |