COX-2 INHIBITOR I
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COX-2 INHIBITOR I
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CAS No:
416901-58-1
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Formula:
C18H16ClNO4S
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Chemical Name:
COX-2 INHIBITOR I
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Synonyms:
METHYL [5-METHYLSULFONYL-1-(4-CHLOROBENZYL)-1H-2-INDOLYL]CARBOXYLATE;LM-1685;COX-2 INHIBITOR I
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CAS No:
Description
LM-1685 is an indolyl carboxylate ester that is methyl 1H-indole-2-carboxylate substituted by a 4-chlorobenzyl group at position 1 and a methylsulfonyl group at position 5. It acts as a selective inhibitor of cyclooxygenase 2. It has a role as a cyclooxygenase 2 inhibitor. It is an indolyl carboxylate ester, a sulfone, a member of monochlorobenzenes and a methyl ester.
Computed Properties
Molecular Weight:377.8
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:377.0488569
Monoisotopic Mass:377.0488569
Topological Polar Surface Area:73.8
Heavy Atom Count:25
Complexity:582
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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- Hot Searches
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