Chemical ID: 3967220

Cn1c(nnn1)SCC2=C(N3C(C(C3=O)(NC(=O)C(c4ccc(cc4)O)C(=O)O)OC)OC2)C(=O)O
Chemical ID:
3967220
Name [?]:
7-[2-carboxy-2-(4-hydroxyphenyl)-acetyl]amino-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES [?]:
Cn1c(nnn1)SCC2=C(N3C(C(C3=O)(NC(=O)C(c4ccc(cc4)O)C(=O)O)OC)OC2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H20N6O9S
All Atoms:36
Heavy Atoms:36
Chiral Atoms:3
ZAP Information [?]
Total:7.65755
Area:649.84
Solvation:-8.58844
Coulombic:-131.043
Bond Count [?]
All:39
Single:29
Double:10
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:520.474
H-Bond Donors:4
H-Bond Acceptors:11
XLogP:-0.89
LogP (Chemaxon):0.62

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Descriptor Annotations

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