AC1MF1QW
17-(3-chloro-4-methylphenyl)-1-ethyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Also Known As: CBMicro_046745|ChemDiv1_026221|Oprea1_311558|HMS661H19|BIM-0046895.P001|AG-205/12550023|SR-01000529079-1|A2226/0093799|17-(3-chloro-4-methylphenyl)-1-ethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione|17-(3-chloro-4-methylphenyl)-1-ethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)|13-(3-chloro-4-methylphenyl)-9-ethyl-10,11-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(13H,15H)-dione|17-(3-chloro-4-methylphenyl)-1-ethyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
| Molecular Formula | C27H22ClNO2 |
|---|---|
| Molecular Weight | 427.1339 g/mol |
| LogP | 5.60922 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 427.1339 |
| Monoisotopic Mass | 427.1339 |
| Heavy Atoms | 31 |
| Complexity | 1232.233 |
Chemical Identifiers
| CAS Number | 309727-20-6 |
|---|---|
| SMILES | CCC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC(=C(C=C6)C)Cl |
Product Overview
AC1MF1QW (CAS 309727-20-6), with molecular formula C27H22ClNO2 and molecular weight 427.1339 g/mol. IUPAC: 17-(3-chloro-4-methylphenyl)-1-ethyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione.