Chemical ID: 6365409

Cc1c(sc(n1)NC(=O)C2CC3CCC2C3)C(=O)OC
Chemical ID:
6365409
Name [?]:
methyl 4-methyl-2-norbornan-2-ylcarbonylamino-thiazole-5-carboxylate
SMILES [?]:
Cc1c(sc(n1)NC(=O)C2CC3CCC2C3)C(=O)OC
InChi [?]:
InChI=1/C14H18N2O3S/c1-7-11(13(18)19-2)20-14(15-7)16-12(17)10-6-8-3-4-9(10)5-8/h8-10H,3-6H2,1-2H3,(H,15,16,17)
InChi Info:
AuxInfo=1/1/N:1,20,13,14,16,11,2,12,15,10,3,8,17,5,6,7,9,18,19,4/rA:20cCCCSCNNCOCCCCCCCCOOC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;s11;s12;s13;s10s14;s12s15;s3;d17;s17;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H18N2O3S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:3
ZAP Information [?]
Total:9.03146
Area:465.264
Solvation:-2.60015
Coulombic:-45.3102
Bond Count [?]
All:22
Single:18
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:294.37
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.94
LogP (Chemaxon):1.73

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Descriptor Annotations

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