1-[(4-chlorophenyl)methyl]-4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)amino]-1H-indol-5-yl diethylcarbamate
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)amino]-1H-indol-5-yl diethylcarbamate
1-[(4-chlorophenyl)methyl]-4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)amino]-1H-indol-5-yl diethylcarbamate
Compound characteristics
| Compound ID: | V003-4927 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)amino]-1H-indol-5-yl diethylcarbamate |
| Molecular Weight: | 552.07 |
| Molecular Formula: | C30 H34 Cl N3 O5 |
| Smiles: | CCN(CC)C(=O)Oc1ccc2c(ccn2Cc2ccc(cc2)[Cl])c1NC(C12CCC(C)(C(=O)O2)C1(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2092 |
| logD: | 5.2058 |
| logSw: | -5.6079 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.142 |
| InChI Key: | ZRQHIOMENMXWEV-UFXYQILXSA-N |