Chemical ID: 4087629

c1cc(oc1)C(=O)Nc2ccc(cc2)C(=O)OC3CCCCC3
Chemical ID:
4087629
Name [?]:
cyclohexyl 4-(2-furylcarbonylamino)benzoate
SMILES [?]:
c1cc(oc1)C(=O)Nc2ccc(cc2)C(=O)OC3CCCCC3
InChi [?]:
InChI=1/C18H19NO4/c20-17(16-7-4-12-22-16)19-14-10-8-13(9-11-14)18(21)23-15-5-2-1-3-6-15/h4,7-12,15H,1-3,5-6H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:21,20,22,1,19,23,2,11,13,10,14,5,12,9,18,3,6,15,8,7,16,4,17/E:(2,3)(5,6)(8,9)(10,11)/rA:23nCCCOCCONCCCCCCCOOCCCCCC/rB:s1;d2;s3;d1s4;s3;d6;s6;s8;s9;d10;s11;d12;d9s13;s12;d15;s15;s17;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19NO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.5114
Area:530.926
Solvation:-2.76175
Coulombic:-51.2367
Bond Count [?]
All:25
Single:18
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:313.348
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.46
LogP (Chemaxon):3.18

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Descriptor Annotations

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