Molecular Identity
Lamotrigine
6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine
PubChem CID: 3878
Lamotrigine is a member of the class of 1,2,4-triazines in which the triazene skeleton is substituted by amino groups at positions 3 and 5, and by a 2,3-dichlorophenyl group at position 6. It has a role as a geroprotector, an antidepressant, an antimanic drug, a non-narcotic analgesic, an anticonvulsant, a xenobiotic, a calcium channel blocker, an excitatory amino acid antagonist, an EC 3.4.21.26 (prolyl oligopeptidase) inhibitor and an environmental contaminant. It is a dichlorobenzene, a member of 1,2,4-triazines and a primary arylamine.
2D Structure
Properties
C9H7Cl2N5
Molecular Formula
256.09
Molecular Weight
g/mol
255.0079
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
90.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
242
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=C(C(=C1)Cl)Cl)C2=C(N=C(N=N2)N)NIsomeric SMILES
SMILES: C1=CC(=C(C(=C1)Cl)Cl)C2=C(N=C(N=N2)N)NSynonyms(20)
lamotrigine84057-84-16-(2,3-Dichlorophenyl)-1,2,4-triazine-3,5-diamineLamictalLamictal CdLamotriginaLamictal XRLamotriginumBW 430C3,5-Diamino-6-(2,3-dichlorophenyl)-1,2,4-triazineBW-430CLamictal ODT1,2,4-Triazine-3,5-diamine, 6-(2,3-dichlorophenyl)-3,5-Diamino-6-(2,3-dichlorophenyl)-as-triazineDTXSID2023195
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Lamotrigine
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