Chemical ID: 3961963

Cc1ccc(cc1C)NC(=O)CN2c3ccccc3C(=O)N4CCCC4C2=O
Chemical ID:
3961963
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1C)NC(=O)CN2c3ccccc3C(=O)N4CCCC4C2=O
InChi [?]:
InChI=1/C22H23N3O3/c1-14-9-10-16(12-15(14)2)23-20(26)13-25-18-7-4-3-6-17(18)21(27)24-11-5-8-19(24)22(25)28/h3-4,6-7,9-10,12,19H,5,8,11,13H2,1-2H3,(H,23,26)
InChi Info:
AuxInfo=1/1/N:1,8,17,16,24,18,15,25,3,4,23,6,12,2,7,5,19,14,26,10,20,27,9,22,13,11,21,28/rA:28cCCCCCCCCNCOCNCCCCCCCONCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;d20;s20;s22;s23;s24;s22s25;s13s26;d27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H23N3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:10.4732
Area:570.826
Solvation:-3.79743
Coulombic:-54.8198
Bond Count [?]
All:31
Single:22
Double:9
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:377.436
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.65
LogP (Chemaxon):2.53

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Descriptor Annotations

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