Basic information
- CAS
178981-89-0- Standard SMILES
CC(C)c1nc(CO)n(Cc2ccncc2)c1Sc1cc(Cl)cc(Cl)c1- InChIKey
RUVDPSJUTNFOLK-UHFFFAOYSA-N- Molecular formula
- C19H19Cl2N3OS
- Average molar mass
- 408.3 g/mol
- Monoisotopic mass
- 407.0625888
Names & identifiers
- Preferred name
- {5-[(3,5-Dichlorophenyl)sulfanyl]-4-isopropyl-1-((pyridin-4-YL)methyl)imidazol-2-YL}methanol
- IUPAC
- [5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methanol
- English name
- {5-[(3,5-Dichlorophenyl)sulfanyl]-4-isopropyl-1-(pyridin-4-ylmethyl)imidazol-2-yl}methanol
- Molecular weight
- 0
Names & synonyms
178981-89-0{5-[(3,5-DICHLOROPHENYL)SULFANYL]-4-ISOPROPYL-1-((PYRIDIN-4-YL)METHYL)IMIDAZOL-2-YL}METHANOL[5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methanolRUVDPSJUTNFOLK-UHFFFAOYSA-NCHEMBL576564SCHEMBL5852651DTXSID90431723{5-[(3,5-Dichlorophenyl)sulfanyl]-4-(propan-2-yl)-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}methanol{5-[(3,5-DICHLOROPHENYL)SULFANYL]-4-ISOPROPYL-1-(PYRIDIN-4-YLMETHYL)IMIDAZOL-2-YL}METHANOL[5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]methanol2-Hydroxymethyl-5-(3,5-dichlorophenylthio)-4-isopropyl-1-(pyridin-4-yl)methyl-1H-imidazole5-(3,5-Dichlorophenylthio)-4-isoproyl-1-(4-pyridylmethyl)-2-hydroxymethyl-1H-imidazole
Show more names
Desamido Capravirine
Database identifiers
- CAS
178981-89-0- PubChem CID
- 9844329
- DTXSID
DTXSID90431723- ChEMBL
CHEMBL576564- Nikkaji
- J1.647.948I
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 429
Chemistry & industry
Suppliers1 total
苏州美石生物科技有限公司1173954148q · [email protected]
Related reactions
14 records
Compound notes
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