Chemical ID: 7667437

Cc1ccccc1NC(=O)CSc2nnc(n2CCOC)c3ccncc3
Chemical ID:
7667437
Name [?]:
None
SMILES [?]:
Cc1ccccc1NC(=O)CSc2nnc(n2CCOC)c3ccncc3
InChi [?]:
InChI=1/C19H21N5O2S/c1-14-5-3-4-6-16(14)21-17(25)13-27-19-23-22-18(24(19)11-12-26-2)15-7-9-20-10-8-15/h3-10H,11-13H2,1-2H3,(H,21,25)
InChi Info:
AuxInfo=1/1/N:1,21,4,5,3,6,23,27,24,26,18,19,11,2,22,7,9,16,13,25,8,15,14,17,10,20,12/E:(7,8)(9,10)/rA:27nCCCCCCCNCOCSCNNCNCCOCCCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;d13;s14;d15;s13s16;s17;s18;s19;s20;s16;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H21N5O2S
All Atoms:48
Heavy Atoms:27
Chiral Atoms:None
ZAP Information [?]
Total:10.6624
Area:616.071
Solvation:-4.73939
Coulombic:-45.0139
Bond Count [?]
All:29
Single:20
Double:9
Rotors:9
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.31
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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