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Chemical ID: 7516216
Chemical ID:
7516216
Name [?]:
2,4,5-trichloro-N-(1-naphthyl)benzenesulfonamide
SMILES [?]:
c1ccc2c(c1)cccc2NS(=O)(=O)c3cc(c(cc3Cl)Cl)Cl
InChi [?]:
InChI=1/C16H10Cl3NO2S/c17-12-8-14(19)16(9-13(12)18)23(21,22)20-15-7-3-5-10-4-1-2-6-11(10)15/h1-9,20H
InChi Info:
AuxInfo=1/0/N:1,2,8,6,7,3,9,19,16,5,4,18,17,20,10,15,22,23,21,11,13,14,12/E:(21,22)/CRV:23.6/rA:23nCCCCCCCCCCNSOOCCCCCCClClCl/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;d12;s12;s15;d16;s17;d18;d15s19;s20;s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H10Cl3NO2S |
All Atoms: | 33 |
Heavy Atoms: | 23 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.724 |
Area: | 526.218 |
Solvation: | -2.43142 |
Coulombic: | -13.7983 |
Bond Count [?]
All: | 25 |
Single: | 15 |
Double: | 10 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.85 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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