Chemical ID: 7686406

CCOC(=O)c1c(nc(s1)N(C(C)C)C(=O)C2CC2)C
Chemical ID:
7686406
Name [?]:
None
SMILES [?]:
CCOC(=O)c1c(nc(s1)N(C(C)C)C(=O)C2CC2)C
InChi [?]:
InChI=1/C14H20N2O3S/c1-5-19-13(18)11-9(4)15-14(20-11)16(8(2)3)12(17)10-6-7-10/h8,10H,5-7H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,13,14,20,2,18,19,12,7,17,6,15,4,9,8,11,16,5,3,10/E:(2,3)(6,7)/rA:20nCCOCOCCNCSNCCCCOCCCC/rB:s1;s2;s3;d4;s4;d6;s7;d8;s6s9;s9;s11;s12;s12;s11;d15;s15;s17;s17s18;s7;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20N2O3S
All Atoms:40
Heavy Atoms:20
Chiral Atoms:None
ZAP Information [?]
Total:9.4076
Area:494.016
Solvation:-2.9428
Coulombic:-40.5777
Bond Count [?]
All:21
Single:17
Double:4
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.58
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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