N'-(5-((3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-chloro-2-pyridinyl)amino)-2-chloro-3-pyridinyl)-N,N-dimethylsulfamide

HCID 59548288

Basic information

Standard SMILES
Cc1nc(N)nc(-c2cc(Cl)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1
InChIKey
KLMZZLVCEDUTEA-UHFFFAOYSA-N
Molecular formula
C16H17Cl2N9O2S
Average molar mass
470.3 g/mol
Monoisotopic mass
469.0602974

Names & identifiers

Preferred name
N'-(5-((3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-chloro-2-pyridinyl)amino)-2-chloro-3-pyridinyl)-N,N-dimethylsulfamide
IUPAC
2-amino-4-[5-chloro-2-[[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]amino]-3-pyridinyl]-6-methyl-1,3,5-triazine

Names & synonyms

CHEMBL2206921SCHEMBL165327KLMZZLVCEDUTEA-UHFFFAOYSA-NBDBM50401261US8772480, 384N'-(5-((3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-chloro-2-pyridinyl)amino)-2-chloro-3-pyridinyl)-N,N-dimethylsulfamide

Database identifiers

PubChem CID
59548288
ChEMBL
CHEMBL2206921

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
160 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
11
Rotatable bonds
6
Heavy atoms
30

Related reactions

3 records

Compound notes

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