Chemical ID: 6261327

Cc1nc2c(s1)ccc3c2sc(n3)NC(=O)COc4ccccc4
Chemical ID:
6261327
Name [?]:
None
SMILES [?]:
Cc1nc2c(s1)ccc3c2sc(n3)NC(=O)COc4ccccc4
InChi [?]:
InChI=1/C17H13N3O2S2/c1-10-18-15-13(23-10)8-7-12-16(15)24-17(19-12)20-14(21)9-22-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,19,20,21)
InChi Info:
AuxInfo=1/1/N:1,22,21,23,20,24,8,7,17,2,19,9,5,15,4,10,12,3,13,14,16,18,6,11/E:(3,4)(5,6)/rA:24nCCNCCSCCCCSCNNCOCOCCCCCC/rB:s1;d2;s3;s4;s2s5;d5;s7;d8;d4s9;s10;s11;s9d12;s12;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H13N3O2S2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.01526
Area:559.659
Solvation:-4.97621
Coulombic:-38.7985
Bond Count [?]
All:27
Single:18
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:355.436
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.35
LogP (Chemaxon):4.32

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