Chemical ID: 5724033

Cc1ccc(cc1NC(=O)CN2c3cccc4c3c(ccc4)S2(=O)=O)Cl
Chemical ID:
5724033
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1NC(=O)CN2c3cccc4c3c(ccc4)S2(=O)=O)Cl
InChi [?]:
InChI=1/C19H15ClN2O3S/c1-12-8-9-14(20)10-15(12)21-18(23)11-22-16-6-2-4-13-5-3-7-17(19(13)16)26(22,24)25/h2-10H,11H2,1H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,15,21,16,22,14,20,3,4,6,11,2,17,5,7,13,19,9,18,26,8,12,10,24,25,23/E:(24,25)/CRV:26.6/rA:26cCCCCCCCNCOCNCCCCCCCCCCSOOCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s18;d19;s20;s17d21;s12s19;d23;d23;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15ClN2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:10.096
Area:555.745
Solvation:-3.79762
Coulombic:-28.4989
Bond Count [?]
All:29
Single:18
Double:11
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:386.853
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.11
LogP (Chemaxon):3.23

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