Chemical ID: 3880719

c1cc(ccc1S(=O)(=O)NCCCO)S(=O)(=O)N2CCCCC2
Chemical ID:
3880719
Name [?]:
N-(3-hydroxypropyl)-4-(1-piperidylsulfonyl)benzenesulfonamide
SMILES [?]:
c1cc(ccc1S(=O)(=O)NCCCO)S(=O)(=O)N2CCCCC2
InChi [?]:
InChI=1/C14H22N2O5S2/c17-12-4-9-15-22(18,19)13-5-7-14(8-6-13)23(20,21)16-10-2-1-3-11-16/h5-8,15,17H,1-4,9-12H2
InChi Info:
AuxInfo=1/0/N:21,20,22,12,1,5,2,4,11,19,23,13,6,3,10,18,14,8,9,16,17,7,15/E:(2,3)(5,6)(7,8)(10,11)(18,19)(20,21)/CRV:22.6,23.6/rA:23nCCCCCCSOONCCCOSOONCCCCC/rB:s1;d2;s3;d4;d1s5;s6;d7;d7;s7;s10;s11;s12;s13;s3;d15;d15;s15;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H22N2O5S2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.29725
Area:555.967
Solvation:-4.60192
Coulombic:-34.8364
Bond Count [?]
All:24
Single:17
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:362.467
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:0.47
LogP (Chemaxon):0.38

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