
IUPAC name
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid
SMILES
COC1=CC2=C(C=C1)N(C(=O)C1=CC=C(Cl)C=C1)C(C)=C2CC(O)=O
Compound class
Gout Suppressants; Anti-Inflammatory Agents; Anti-Inflammatory Agents, Non-Steroidal; Cyclooxygenase Inhibitors; Cardiovascular Agents; Tocolytic Agents; Ophthalmologicals; Sensory Organs; Musculo-Skeletal System; Cardiovascular System; Cardiac Therapy; Acetic Acid Derivatives and Related Substances; Antiinflammatory and Antirheumatic Products, Non-Steroids; Antiinflammatory and Antirheumatic Products; Antiinflammatory Preparations, Non-Steroids for Topical Use; Topical Products for Joint and Muscular Pain; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C19 Inducers;
Therapeutic area
For moderate to severe rheumatoid arthritis including acute flares of chronic disease, ankylosing spondylitis, osteoarthritis, acute painful shoulder (bursitis and/or tendinitis) and acute gouty arthritis.
Common name
Indomethacin
IUPAC name
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid
SMILES
COC1=CC2=C(C=C1)N(C(=O)C1=CC=C(Cl)C=C1)C(C)=C2CC(O)=O
INCHI
InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
FORMULA
C19H16ClNO4

Common name
Indomethacin
IUPAC name
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid
Molecular weight
357.788
clogP
3.908
clogS
-4.729
HBond Acceptor
4
HBond Donor
1
Total Polar Surface Area
68.53
Number of Rings
3
Rotatable Bond
5
Drug ID | Common name | Structure CAS | SMILE | Frequency |
---|---|---|---|---|
FDBF00004 | acetic acid |
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CC(=O)O | 0.0687 |
FDBF00016 | chlorobenzene |
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c1ccc(cc1)Cl | 0.0718 |
FDBF00724 | 5-methoxy-2-methyl-indole-1-carbaldehyde |
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O(C)c1cc2c(n(c(c2)C)C=O)cc1 | 0.0003 |
FDBF00725 | 2-(1-formyl-2-methyl-indol-3-yl)acetic acid |
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C(C(=O)O)c1c2c(n(c1C)C=O)cccc2 | 0.0003 |
FDBF00728 | 2-methylindole-1-carbaldehyde |
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O=Cn1c2c(cc1C)cccc2 | 0.0003 |