Chemical ID: 3951389

Cc1ccc2c(c1)N(C(=O)C(O2)C(C)C)CC(=O)NC(C)C
Chemical ID:
3951389
Name [?]:
N-isopropyl-2-(3-isopropyl-8-methyl-4-oxo-2-oxa-5-azabicyclo[4.4.0]deca-7,9,11-trien-5-yl)-acetamide
SMILES [?]:
Cc1ccc2c(c1)N(C(=O)C(O2)C(C)C)CC(=O)NC(C)C
InChi [?]:
InChI=1/C17H24N2O3/c1-10(2)16-17(21)19(9-15(20)18-11(3)4)13-8-12(5)6-7-14(13)22-16/h6-8,10-11,16H,9H2,1-5H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:14,15,21,22,1,3,4,7,16,13,20,2,6,5,17,11,9,19,8,18,10,12/E:(1,2)(3,4)/rA:22cCCCCCCCNCOCOCCCCCONCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s5s11;s11;s13;s13;s8;s16;d17;s17;s19;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H24N2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:8.88555
Area:507.132
Solvation:-3.79276
Coulombic:-46.5057
Bond Count [?]
All:23
Single:18
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:304.384
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.47
LogP (Chemaxon):2.15

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