Chemical ID: 6007203

CCCCCCC(=O)N(CCCOCC)CC(=O)Nc1nc(cs1)C
Chemical ID:
6007203
Name [?]:
N-(3-ethoxypropyl)-N-[(4-methylthiazol-2-yl)carbamoylmethyl]heptanamide
SMILES [?]:
CCCCCCC(=O)N(CCCOCC)CC(=O)Nc1nc(cs1)C
InChi [?]:
InChI=1/C18H31N3O3S/c1-4-6-7-8-10-17(23)21(11-9-12-24-5-2)13-16(22)20-18-19-15(3)14-25-18/h14H,4-13H2,1-3H3,(H,19,20,22)
InChi Info:
AuxInfo=1/1/N:1,15,25,2,14,3,4,5,11,6,10,12,16,23,22,17,7,20,21,19,9,18,8,13,24/rA:25nCCCCCCCONCCCOCCCCONCNCCSC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;s11;s12;s13;s14;s9;s16;d17;s17;s19;d20;s21;d22;s20s23;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H31N3O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.2247
Area:660.331
Solvation:-5.28359
Coulombic:-48.921
Bond Count [?]
All:25
Single:21
Double:4
Rotors:15
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:369.523
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.83
LogP (Chemaxon):2.42

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Descriptor Annotations

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