Basic information
- CAS
495402-78-3- Standard SMILES
Cc1ccc(N2C(=O)C3C4C=CC(C3C2=O)C2C(=O)N(c3ccc(C)c(Cl)c3)C(=O)C42)cc1Cl- InChIKey
HPMFRSLVILBDQY-UHFFFAOYSA-N- Molecular formula
- C26H20Cl2N2O4
- Average molar mass
- 495.3 g/mol
Names & identifiers
- Preferred name
- CID 2929581
- IUPAC
- 4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
- English name
- 4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.0~2,6~.0~8,12~]tetradec-13-ene-3,5,9,11-tetrone
- Molecular formula
- C26H20Cl2N2O4
- Molecular weight
- 495.354
Names & synonyms
AO-081/15245172AKOS0004777602,6-bis(3-chloro-4-methylphenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.0~2,6~.0~8,12~]tetradec-13-ene-3,5,9,11-tetrone4,10-Bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone495402-78-3
Database identifiers
- CAS
495402-78-3
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 864
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
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Compound notes
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