3-(1-tert-butyl-1H-tetrazol-5-yl)-2-[(3-methylphenyl)methyl]-8-oxa-2-azaspiro[4.5]decan-1-one
Chemical Structure Depiction of
3-(1-tert-butyl-1H-tetrazol-5-yl)-2-[(3-methylphenyl)methyl]-8-oxa-2-azaspiro[4.5]decan-1-one
3-(1-tert-butyl-1H-tetrazol-5-yl)-2-[(3-methylphenyl)methyl]-8-oxa-2-azaspiro[4.5]decan-1-one
Compound characteristics
| Compound ID: | S525-0579 |
| Compound Name: | 3-(1-tert-butyl-1H-tetrazol-5-yl)-2-[(3-methylphenyl)methyl]-8-oxa-2-azaspiro[4.5]decan-1-one |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C21 H29 N5 O2 |
| Smiles: | Cc1cccc(CN2C(CC3(CCOCC3)C2=O)c2nnnn2C(C)(C)C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9033 |
| logD: | 2.9033 |
| logSw: | -3.0006 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.601 |
| InChI Key: | NFCJFLKVCKZLLJ-QGZVFWFLSA-N |