Basic information
- CAS
5588-20-5- Standard SMILES
CCCCC(CC)C1NC(=O)N(SC(Cl)(Cl)Cl)C1=O- InChIKey
VOGJJBHRUDVEFM-UHFFFAOYSA-N- Molecular formula
- C11H17Cl3N2O2S
- Average molar mass
- 347.7 g/mol
- Monoisotopic mass
- 346.007632
Overview
Clodantoin is an imidazolidine-2,4-dione.
Names & identifiers
- Preferred name
- Chlordantoin
- IUPAC
- 5-heptan-3-yl-3-(trichloromethylsulfanyl)imidazolidine-2,4-dione
- English name
- clodantoin
- Molecular formula
- C11H17Cl3N2O2S
- Molecular weight
- 347.69
Names & synonyms
ClodantoinChlordantoin5588-20-5ClodantoinaClodantoineClodantoinumNSC-2314273-Trichloromethylthio-5-(1-ethylamyl)-hydantoinW14Z7581PA2,4-Imidazolidinedione, 5-(1-ethylpentyl)-3-((trichloromethyl)thio)-5-(1-Ethylpentyl)-3-((trichloromethyl)thio)hydantoinHydantoin, 5-(1-ethylpentyl)-3-((trichloromethyl)thio)-
Show more names
Clodantocide5-(1-Ethylpentyl)-3-trichloromethylthiohydantoin5-heptan-3-yl-3-(trichloromethylsulfanyl)imidazolidine-2,4-dione2,4-Imidazolidinedione, 5-(1-ethylpentyl)-3-[(trichloromethyl)thio]-
DTXSID408635755-(1-Ethylpentyl)-3-(trichloromethylthio)hydantoin5-(1-Ethylpentyl)-3-[(trichloromethyl)thio]hydantoinHydantoin, 5-(1-ethylpentyl)-3-[(trichloromethyl)thio]-5-(heptan-3-yl)-3-[(trichloromethyl)sulfanyl]imidazolidine-2,4-dione5-(heptan-3-yl)-3-((trichloromethyl)sulfanyl)imidazolidine-2,4-dioneRefChem:125299DTXCID30812173
Database identifiers
- CAS
5588-20-5
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 349
Physicochemical properties
- Density
- 1.3479 · 1.3479 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- form
- Solid
- pka
- 6.46 · 6.46±0.70(Predicted)
- color
- Light yellow to yellow
- FDA UNII
- 14 Z7581PA · W14Z7581PA
- ATC code
- 1 AX01 · G01AX01
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Pharmacology
ATC Code
G - Genito urinary system and sex hormones
QG - Genito urinary system and sex hormones
Applications
UsesAntifungal.
UsesChlordantoin, is an antifungal drug which can be used to treat vaginal candidiasis.
Upstream & downstream products
Upstream raw materials
Suppliers11 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Aladdin Scientific[email protected]
銳迪國際科技有限公司18024082417 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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