1,3,5-Triazine-2,4-diamine, 1-(3-chlorophenyl)-1,6-dihydro-6,6-dimethyl-
Basic information
- CAS
13351-02-5- Standard SMILES
CC1(C)N=C(N)N=C(N)N1c1cccc(Cl)c1- InChIKey
AXIUXECRTOGILY-UHFFFAOYSA-N- Molecular formula
- C11H14ClN5
- Average molar mass
- 251.71 g/mol
- Monoisotopic mass
- 251.0937732
Names & identifiers
- Preferred name
- 1,3,5-Triazine-2,4-diamine, 1-(3-chlorophenyl)-1,6-dihydro-6,6-dimethyl-
- IUPAC
- 1-(3-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
Names & synonyms
13351-02-51-(3-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamineX 4847GU3ESV2R1,3,5-Triazine-2,4-diamine, 1-(3-chlorophenyl)-1,6-dihydro-6,6-dimethyl-D 691-(3-chlorophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamineNSC 3080UNII-47GU3ESV2RCHEMBL7130NSC3080NSC-3080
Show more names
SCHEMBL670885DTXSID70158148BDBM50090054EBC-46163AKOS016874979NCI60_002634PD081715EN300-26754525
Database identifiers
- CAS
13351-02-5- PubChem CID
- 407233
- DTXSID
DTXSID70158148- ChEMBL
CHEMBL7130- UNII
- 47GU3ESV2R
- Nikkaji
- J424.932A
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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