1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-[[2-[(1R,5S)-3,6-diazabicyclo[3.1.1]heptan-3-yl]-7-(1,3-thiazol-2-yl)-1,3-benzoxazol-4-yl]oxy]-1,1-difluoro-2-methylpropan-2-ol

2.1.2 InChI

InChI=1S/C19H20F2N4O3S/c1-18(2,26)19(20,21)28-13-4-3-12(16-22-5-6-29-16)15-14(13)24-17(27-15)25-8-10-7-11(9-25)23-10/h3-6,10-11,23,26H,7-9H2,1-2H3/t10-,11+

2.1.3 InChI Key

FJBDQIRRDKSQTK-PHIMTYICSA-N

2.2 Other Identifiers

2.2.1 UNII

4QZD1V144B

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. Morcamilast [inn]

2. 4qzd1v144b

3. Me3183

4. Me-3183

5. 1-[[2-(3,6-diazabicyclo[3.1.1]hept-3-yl)-7-(2-thiazolyl)-4-benzoxazolyl]oxy]-1,1-difluoro-2-methyl-2-propanol

6. 2-propanol, 1-[[2-(3,6-diazabicyclo[3.1.1]hept-3-yl)-7-(2-thiazolyl)-4-benzoxazolyl]oxy]-1,1-difluoro-2-methyl-

2.4 Create Date

2025-08-26

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₂₀F₂N₄O₃S
Molecular Weight	422.5 g/mol
XLogP3	3.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	5
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	112
Heavy Atom Count	29
Formal Charge	0
Complexity	620
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

Morcamilast

Morcamilast

ACCESS ALL DATA

CHEMISTRY

Discover Molecule Insights

Filters