Basic information
- CAS
315244-85-0- Standard SMILES
Cc1[nH]nc2c1C(c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2- InChIKey
ZCLQCDNEWGXHBY-UHFFFAOYSA-N- Molecular formula
- C14H10Cl2N4O
- Average molar mass
- 321.2 g/mol
- Monoisotopic mass
- 320.0231663
Names & identifiers
- Preferred name
- 6-Amino-4-(3,4-dichlorophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
- IUPAC
- 6-amino-4-(3,4-dichlorophenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Names & synonyms
6-Amino-4-(3,4-dichlorophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile6-amino-4-(3,4-dichlorophenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile315244-85-0ZCLQCDNEWGXHBY-UHFFFAOYSA-NDTXSID801337488STK788439AKOS001738895AKOS002265449AKOS016310337AKOS022012734ST4041564ST50448900
Show more names
SR-01000521588SR-01000521588-16-Amino-4-(3,4-dichlorophenyl)-1,4-dihydro-3-methylpyrano[2,3-c]pyrazole-5-carbonitrile6-Amino-4-(3,4-dichlorophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile #6-amino-4-(3,4-dichlorophenyl)-3-methyl-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrilePyrazolo[3,4-b]pyran-5-carbonitrile, 1,4-dihydro-6-amino-4-(3,4-dichlorophenyl)-3-methyl-
Database identifiers
- CAS
315244-85-0- PubChem CID
- 600136
- DTXSID
DTXSID801337488- Nikkaji
- J2.846.933K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 502
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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