Mls002608698
Basic information
- CAS
7250-37-5- Standard SMILES
Oc1c(Cl)cc(Oc2cc(Cl)c(O)c(CN3CCOCC3)c2)cc1CN1CCOCC1- InChIKey
OSYFJLSHWOAYDF-UHFFFAOYSA-N- Molecular formula
- C22H26Cl2N2O5
- Average molar mass
- 469.4 g/mol
- Monoisotopic mass
- 468.1218773
Names & identifiers
- Preferred name
- Mls002608698
- IUPAC
- 2-chloro-4-[3-chloro-4-hydroxy-5-(morpholin-4-ylmethyl)phenoxy]-6-(morpholin-4-ylmethyl)phenol
Names & synonyms
MLS0026086987250-37-5DTXSID20286384RefChem:357148DTXCID80237534NSC45145CHEMBL1717279HMS3080H15NSC-45145SMR0015274434,4'-Oxybis{2-chloro-6-[(morpholin-4-yl)methyl]phenol}
Database identifiers
- CAS
7250-37-5- PubChem CID
- 239740
- DTXSID
DTXSID20286384- ChEMBL
CHEMBL1717279
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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