Chemical ID: 4950653

CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2
Chemical ID:
4950653
Name [?]:
N,N-diethyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
SMILES [?]:
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2
InChi [?]:
InChI=1/C13H20N2O2S/c1-3-15(4-2)18(16,17)12-7-8-13-11(10-12)6-5-9-14-13/h7-8,10,14H,3-6,9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,16,15,10,11,17,14,13,9,12,18,3,7,8,6/E:(1,2)(3,4)(16,17)/CRV:18.6/rA:18nCCNCCSOOCCCCCCCCCN/rB:s1;s2;s3;s4;s3;d6;d6;s6;s9;d10;s11;d12;d9s13;s13;s15;s16;s12s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H20N2O2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.8638
Area:434.113
Solvation:-1.98902
Coulombic:-18.9867
Bond Count [?]
All:19
Single:14
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:268.376
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.81
LogP (Chemaxon):1.81

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Descriptor Annotations

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