Chemical ID: 5911279

Cc1ccc(o1)CN(Cc2ccc3c(c2)OCO3)C(=O)CCc4ccccc4
Chemical ID:
5911279
Name [?]:
N-(benzo[1,3]dioxol-5-ylmethyl)-N-[(5-methyl-2-furyl)methyl]-3-phenyl-propanamide
SMILES [?]:
Cc1ccc(o1)CN(Cc2ccc3c(c2)OCO3)C(=O)CCc4ccccc4
InChi [?]:
InChI=1/C23H23NO4/c1-17-7-10-20(28-17)15-24(23(25)12-9-18-5-3-2-4-6-18)14-19-8-11-21-22(13-19)27-16-26-21/h2-8,10-11,13H,9,12,14-16H2,1H3
InChi Info:
AuxInfo=1/0/N:1,26,25,27,24,28,3,11,22,4,12,21,15,9,7,17,2,23,10,5,13,14,19,8,20,18,16,6/E:(3,4)(5,6)/rA:28nCCCCCOCNCCCCCCCOCOCOCCCCCCCC/rB:s1;d2;s3;d4;s2s5;s5;s7;s8;s9;s10;d11;s12;d13;d10s14;s14;s16;s13s17;s8;d19;s19;s21;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H23NO4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.2929
Area:608.774
Solvation:-4.9265
Coulombic:-40.3606
Bond Count [?]
All:31
Single:22
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:377.433
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.66
LogP (Chemaxon):3.9

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Descriptor Annotations

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