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Catramilast

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Name

Catramilast

EINECS N/A
CAS No. 183659-72-5 Density 1.170 g/cm3
PSA 56.25000 LogP 2.77750
Solubility N/A Melting Point N/A
Formula C17H22N2O3 Boiling Point N/A
Molecular Weight 302.373 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 183659-72-5 (Catramilast) Hazard Symbols N/A
Synonyms

2H-Imidazol-2-one,1-[2-[3-(cyclopropylmethoxy)-4-methoxyphenyl]propyl]-1,3-dihydro-, (S)-;Catramilast;R 115500;

Article Data 2

Catramilast Specification

This chemical is called Catramilast, and its systematic name is 2H-Imidazol-2-one, 1-(2-(3-(cyclopropylmethoxy)-4-
methoxyphenyl)propyl)- 1,3-dihydro-, (S)-. With the molecular formula of C17H22N2O3, its molecular weight is 302.37. The CAS registry number of this chemical is 183659-72-5, and its classification code is Treatment of Atopic Dermatitis.

Other characteristics of the Catramilast can be summarised as followings: (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 3; (3)Rotatable Bond Count: 7; (4)Tautomer Count: 2; (5)Exact Mass: 302.163043; (6)MonoIsotopic Mass: 302.163043; (7)Topological Polar Surface Area: 50.8; (8)Heavy Atom Count: 22; (9)Formal Charge: 0; (10)Complexity: 422; (11)Isotope Atom Coun:t 0; (12)Defined Atom StereoCenter Count: 1; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1; (17)Feature 3D Acceptor Count: 3; (18)Feature 3D Donor Count: 1; (19)Feature 3D Hydrophobe Count: 1; (20)Feature 3D Ring Count: 2.

You can still convert the following datas into molecular structure: 
1.InChI: InChI=1/C17H22N2O3/c1-12(10-19-8-7-18-17(19)20)14-5-6-15(21-2)16(9-14)22-11-13-3-4-13/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,18,20)/t12-/m1/s1
2.Smiles: c1(cc(c(cc1)OC)OCC1CC1)[C@H](C)Cn1c([nH]cc1)=O

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