Cilomilast

C20H25NO4CAS 153259-65-5343.42 g/mol

Open in Covalent MOL file
ONOOHO
Carboxylic acidEtherNitrile

Properties

Molecular formula
C20H25NO4
Molar mass
343.42 g/mol
Exact mass
343.1784 Da
Melting point
157 °C
logP
4.05Crippen estimate
Polar surface area
79.5 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
5
Stereocentres
s, sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Search the SDS library

Identifiers

CAS number
153259-65-5
SMILES
COc1ccc([C@]2(C#N)CC[C@@H](C(=O)O)CC2)cc1OC1CCCC1
InChIKey
CFBUZOUXXHZCFB-OYOVHJISNA-N
InChI
InChI=1/C20H25NO4/c1-24-17-7-6-15(12-18(17)25-16-4-2-3-5-16)20(13-21)10-8-14(9-11-20)19(22)23/h6-7,12,14,16H,2-5,8-11H2,1H3,(H,22,23)/t14-,20-

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Cyclohexanecarboxylic acid, 4-cyano-4-[3-(cyclopentyloxy)-4-methoxyphenyl]-, cis-
  • cis-4-Cyano-4-[3-(cyclopentyloxy)-4-methoxyphenyl]cyclohexanecarboxylic acid
  • cis-4-[3-(Cyclopentyloxy)-4-methoxyphenyl]-4-cyanocyclohexane-1-carboxylic acid
  • SB 207499
  • Ariflo

Work with Cilomilast

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-(Cyclopentyloxy)-4-methoxyphenyl isocyanate185300-51-042 % similar 3-Cyclopentyloxy-4-methoxybenzaldehyde67387-76-242 % similar Rolipram61413-54-540 % similar 1-(2,2-Difluorobenzo[D][1,3]dioxol-5-yl)cyclopropanecarbonitrile862574-87-636 % similar Norverapamil hydrochloride67812-42-436 % similar 3-Methoxy-O-methyl-L-tyrosine32161-30-136 % similar (S)-2-Amino-3-(3,4-dimethoxy-phenyl)-propionic acid55-59-436 % similar Verapamil hydrochloride152-11-435 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook