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Palovarotene

Palovarotene structure

CAS No:
410528-02-8
Formula:
C27H30N2O2
Chemical Name:
Palovarotene
Synonyms:
Benzoic acid,4-[(1E)-2-[5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-3-(1H-pyrazol-1-ylmethyl)-2-naphthalenyl]ethenyl]-;4-[(1E)-2-[5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-3-(1H-pyrazol-1-ylmethyl)-2-naphthalenyl]ethenyl]benzoic acid;R 667;Ro 3300074;Palovarotene;4-{(1E)-2-[5,5,8,8-tetramethyl-3-(1H-pyrazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]ethenyl}benzoicacid;CLM 001;IPN 60120;Sohonos
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

Palovarotene has been used in trials studying the treatment of Fibrodysplasia Ossificans Progressiva.|Palovarotene is an orally available, selective retinoic acid receptor gamma agonist. Palovarotene selectively binds to the gamma retinoid agonist, thereby reducing inflammation and enhancing repair.

Palovarotene Basic Attributes

Molecular Weight：

414.54

Exact Mass：

414.54

EC Number：

200-258-5

UNII：

28K6I5M16G

NCI Thesaurus Code：

C80661

ATC Code：

M - Musculo-skeletal system

Characteristics

PSA：

55.12000

XLogP3：

6.14900

Density：

1.11

Boiling Point：

592.3±50.0 °C(Predicted)

PKA：

4.26±0.10

Drug Information

Drug Indication：

Treatment of multiple osteochondromas|Treatment of fibrodysplasia ossificans progressiva

MeSH Entry Terms：

Palovarotene

Palovarotene Use and Manufacturing

Use Classification：

Human drugs -> Rare disease (orphan)|Human Drugs -> EU pediatric investigation plans

Computed Properties

Molecular Weight:414.5
XLogP3:6.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:414.230728204
Monoisotopic Mass:414.230728204
Topological Polar Surface Area:55.1
Heavy Atom Count:31
Complexity:662
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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