Chemical ID: 6876047

CCOc1ccc(cc1)NC(=O)COC(=O)C=Cc2ccc(cc2)F
Chemical ID:
6876047
Name [?]:
(4-ethoxyphenyl)carbamoylmethyl 3-(4-fluorophenyl)prop-2-enoate
SMILES [?]:
CCOc1ccc(cc1)NC(=O)COC(=O)C=Cc2ccc(cc2)F
InChi [?]:
InChI=1/C19H18FNO4/c1-2-24-17-10-8-16(9-11-17)21-18(22)13-25-19(23)12-5-14-3-6-15(20)7-4-14/h3-12H,2,13H2,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,20,24,18,21,23,6,8,5,9,17,13,19,22,7,4,11,15,25,10,12,16,3,14/E:(3,4)(6,7)(8,9)(10,11)/rA:25nCCOCCCCCCNCOCOCOCCCCCCCCF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;d11;s11;s13;s14;d15;s15;w17;s18;s19;d20;s21;d22;d19s23;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18FNO4
All Atoms:43
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.52164
Area:560.727
Solvation:-5.49654
Coulombic:-51.5462
Bond Count [?]
All:26
Single:17
Double:9
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:343.349
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.47
LogP (Chemaxon):3.5

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