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4-[[4-Chloro-6-(4-sulfochloranuidylanilino)-1,3,5-triazin-2-yl]amino]-2-[(14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)amino]benzenesulfonic acid

HCID 21136751
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
No structure available

Basic information

InChIKey
YQROOHYFAXZIPX-UHFFFAOYSA-N
Molecular formula
C32H22Cl2N7O8S2-
Average molar mass
767.6 g/mol

Names & identifiers

Preferred name
4-[[4-Chloro-6-(4-sulfochloranuidylanilino)-1,3,5-triazin-2-yl]amino]-2-[(14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)amino]benzenesulfonic acid
IUPAC
4-[[4-chloro-6-(4-sulfochloranuidylanilino)-1,3,5-triazin-2-yl]amino]-2-[(14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)amino]benzenesulfonic acid

Database identifiers

PubChem CID
21136751

Properties

Computed structural propertiesFilling in

XLogP
5.5
Topological polar surface area
238 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
15
Rotatable bonds
8
Heavy atoms
51
Formal charge
-1
Complexity
1,570

Related reactions

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Compound notes

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