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Basic information
- CAS
26279-89-0- Standard SMILES
COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(=O)CCl)CC2- InChIKey
XBFWCWRZDWNRIE-HNNXBMFYSA-N- Molecular formula
- C22H24ClNO6
- Average molar mass
- 433.9 g/mol
- Monoisotopic mass
- 433.1292152
Names & identifiers
- Preferred name
- Chlorcolchicine
- IUPAC
- 2-chloro-N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Names & synonyms
Chlorcolchicine26279-89-0DTXSID90180906RefChem:125297DTXCID90103397ChlorocolchicineCOLCHICINE, 17-CHLORO-17-ChlorocolchicineNSC 142024BRN 2790212Acetamide, 2-chloro-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-CHEMBL315180
Show more names
NSC142024NSC164850NSC-142024NSC-164850Acetamide, 2-chloro-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-, (S)-Acetamide,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl)2-Chloro-N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Database identifiers
- CAS
26279-89-0- PubChem CID
- 33463
- DTXSID
DTXSID90180906- ChEMBL
CHEMBL315180
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 761
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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