as-Triazine, 1,4,5,6-tetrahydro-3-(p-chlorodiphenylmethyl)-1,5-dimethyl-
Basic information
- CAS
22201-95-2- Standard SMILES
CC1CN(C)NC(C(c2ccccc2)c2ccc(Cl)cc2)=N1- InChIKey
IQFMEXHXCCJRKA-UHFFFAOYSA-N- Molecular formula
- C18H20ClN3
- Average molar mass
- 313.8 g/mol
- Monoisotopic mass
- 313.1345753
Names & identifiers
- Preferred name
- as-Triazine, 1,4,5,6-tetrahydro-3-(p-chlorodiphenylmethyl)-1,5-dimethyl-
- IUPAC
- 3-[(4-chlorophenyl)-phenylmethyl]-1,5-dimethyl-5,6-dihydro-2H-1,2,4-triazine
- English name
- 1,4,5,6-Tetrahydro-3-(p-chlorodiphenylmethyl)-1,5-dimethyl-as-triazine
- Molecular weight
- 0
Names & synonyms
BRN 159008422201-95-21,4,5,6-Tetrahydro-3-(p-chlorodiphenylmethyl)-1,5-dimethyl-as-triazine3-(p-Chlorodiphenylmethyl)-1,5-dimethyl-1,4,5,6-tetrahydro-as-triazineas-Triazine, 1,4,5,6-tetrahydro-3-(p-chlorodiphenylmethyl)-1,5-dimethyl-as-Triazine, 3-(p-chlorodiphenylmethyl)-1,5-dimethyl-1,4,5,6-tetrahydro-RefChem:3200983-[(4-chlorophenyl)(phenyl)methyl]-1,5-dimethyl-1,2,5,6-tetrahydro-1,2,4-triazineDTXSID109448603-(p-Chloro-α-phenylbenzyl)-1,4,5,6-tetrahydro-1,5-dimethyl-1,2,4-triazine3-(4-Chloro-α-phenylbenzyl)-1,4,5,6-tetrahydro-1,5-dimethyl-1,2,4-triazine
Database identifiers
- CAS
22201-95-2- PubChem CID
- 90755
- DTXSID
DTXSID10944860- Nikkaji
- J49.136E
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 384
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Related reactions
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Compound notes
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