Chemical ID: 6007289

c1csc(n1)NC(=O)CN(C2CCCCC2)C(=O)c3cc(cc(c3)Cl)Cl
Chemical ID:
6007289
Name [?]:
3,5-dichloro-N-cyclohexyl-N-(thiazol-2-ylcarbamoylmethyl)benzamide
SMILES [?]:
c1csc(n1)NC(=O)CN(C2CCCCC2)C(=O)c3cc(cc(c3)Cl)Cl
InChi [?]:
InChI=1/C18H19Cl2N3O2S/c19-13-8-12(9-14(20)10-13)17(25)23(15-4-2-1-3-5-15)11-16(24)22-18-21-6-7-26-18/h6-10,15H,1-5,11H2,(H,21,22,24)
InChi Info:
AuxInfo=1/1/N:14,13,15,12,16,1,2,20,24,22,9,19,21,23,11,7,17,4,26,25,5,6,10,8,18,3/E:(2,3)(4,5)(8,9)(13,14)(19,20)/rA:26nCCSCNNCOCNCCCCCCCOCCCCCCClCl/rB:d1;s2;s3;s1d4;s4;s6;d7;s7;s9;s10;s11;s12;s13;s14;s11s15;s10;d17;s17;s19;d20;s21;d22;d19s23;s23;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19Cl2N3O2S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.2991
Area:610.449
Solvation:-4.96214
Coulombic:-42.1642
Bond Count [?]
All:28
Single:21
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:412.334
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.95
LogP (Chemaxon):4.15

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Descriptor Annotations

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