Chemical ID: 4700739

CC1(NC(=O)N(N1)c2ccc(cc2Cl)Cl)C3=NOC4C3C(=O)N(C4=O)N(C)c5c(cc(cn5)C(F)(F)F)Cl
Chemical ID:
4700739
Name [?]:
3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]-methyl-amino]-6-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-8-oxa-3,7-diazabicyclo[3.3.0]oct-6-ene-2,4-dione
SMILES [?]:
CC1(NC(=O)N(N1)c2ccc(cc2Cl)Cl)C3=NOC4C3C(=O)N(C4=O)N(C)c5c(cc(cn5)C(F)(F)F)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H15Cl3F3N7O4
All Atoms:38
Heavy Atoms:38
Chiral Atoms:4
ZAP Information [?]
Total:11.3867
Area:734.544
Solvation:-6.97686
Coulombic:-84.4999
Bond Count [?]
All:42
Single:32
Double:10
Rotors:5
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:592.742
H-Bond Donors:2
H-Bond Acceptors:10
XLogP:3.33
LogP (Chemaxon):5.29

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