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Chemical ID: 7247427
Chemical ID:
7247427
Name [?]:
N-(1H-indazol-6-yl)propane-1-sulfonamide
SMILES [?]:
CCCS(=O)(=O)Nc1ccc2cn[nH]c2c1
InChi [?]:
InChI=1/C10H13N3O2S/c1-2-5-16(14,15)13-9-4-3-8-7-11-12-10(8)6-9/h3-4,6-7,13H,2,5H2,1H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,10,9,3,16,12,11,8,15,13,14,7,5,6,4/E:(14,15)/CRV:16.6/rA:16nCCCSOONCCCCCNNCC/rB:s1;s2;s3;d4;d4;s4;s7;s8;d9;s10;s11;d12;s13;d11s14;d8s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H13N3O2S |
All Atoms: | 29 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.9325 |
Area: | 405.523 |
Solvation: | -3.20557 |
Coulombic: | -18.6729 |
Bond Count [?]
All: | 17 |
Single: | 11 |
Double: | 6 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 239.295 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 2.1 |
LogP (Chemaxon): | 1.21 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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