Structure Info
- Chemspace ID
- CSSS00010896712 (In-Stock Screening Compounds)
- CAS
- 1823961-84-7, 1588769-41-8
- MFCD
- MFCD26521122
- IUPAC Name
- methyl 5-bromo-6-chloropyrazine-2-carboxylate
- Mol formula
- C6H4BrClN2O2
- Mol weight
- 251 Da
- Catalog Number(s)
- A1058691, AR01DZRL, AX31397, ArZ-UP202811, BB4LS-EN300-1694032, BBV-54502263, BD01030498, CS-0565342, CSC010896712, EN300-1694032, GS3820, Y3138985, YXC96184, Z1813200188, ZX-NM246086, ZXC340416
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.53
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.16666666666667
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00010896712
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