Chemical Properties of Clobazam (CAS 22316-47-8)

InChI

InChI=1S/C16H13ClN2O2/c1-18-13-8-7-11(17)9-14(13)19(16(21)10-15(18)20)12-5-3-2-4-6-12/h2-9H,10H2,1H3

InChI Key

CXOXHMZGEKVPMT-UHFFFAOYSA-N

Formula

C16H13ClN2O2

SMILES

CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21

Molecular Weight¹

300.74

CAS

22316-47-8

Other Names

• 1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-methyl-5-phenyl-
• Chlorepin
• Clorepin
• H 4723
• HR 376
• LM 2717
• RU-4723
• Urbanyl
• 1-Phenyl-5-methyl-8-chloro-1,2,4,5-tetrahydro-2,4-dioxo-3H-1,5-benzodiazepine
• 7-Chloro-1-methyl-5-phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
• Frisium
• Urbadan
• Clobazepam
• NSC 336279

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-3.63		Crippen Calculated Property
logPoct/wat	3.371		Crippen Calculated Property
McVol	213.260	ml/mol	McGowan Calculated Property
Inp	[2557.00; 2647.60]
Inp	2582.00		NIST
Inp	2565.00		NIST
Inp	Outlier 2647.60		NIST
Inp	2605.00		NIST
Inp	2582.00		NIST
Inp	2582.00		NIST
Inp	2559.00		NIST
Inp	2557.00		NIST
Inp	2582.00		NIST
Tfus	455.10 ± 0.50	K	NIST

Similar Compounds

Find more compounds similar to Clobazam.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.