Basic information
- CAS
112290-21-8- Standard SMILES
CCOC(=O)c1c(NC(=O)COc2ccc(Cl)cc2)sc2c1C1CCN2CC1- InChIKey
WQGKLJCFLHVUOA-UHFFFAOYSA-N- Molecular formula
- C20H21ClN2O4S
- Average molar mass
- 420.9 g/mol
- Monoisotopic mass
- 420.091056
Names & identifiers
- Preferred name
- 4H-4,7-Ethanothieno(2,3-b)pyridine-3-carboxylic acid, 5,6-dihydro-2-(((4-chlorophenoxy)acetyl)amino)-, ethyl ester
- IUPAC
- ethyl 4-[[2-(4-chlorophenoxy)acetyl]amino]-3-thia-1-azatricyclo[5.2.2.02,6]undeca-2(6),4-diene-5-carboxylate
- English name
- 2-(4-Chlorophenoxyacetylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidi ne
- Molecular formula
- C20H21ClN2O4S
- Molecular weight
- 420.91
Names & synonyms
112290-21-8BRN 57770194H-4,7-Ethanothieno(2,3-b)pyridine-3-carboxylic acid, 5,6-dihydro-2-(((4-chlorophenoxy)acetyl)amino)-, ethyl ester2-(4-Chlorophenoxyacetylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidineDTXSID70149975RefChem:297462DTXCID7072466Oprea1_1349902-(4-Chlorophenoxyacetylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidi neAKOS024281015ethyl 4-[[2-(4-chlorophenoxy)acetyl]amino]-3-thia-1-azatricyclo[5.2.2.02,6]undeca-2(6),4-diene-5-carboxylateST037171
Show more names
4H-4,7-Ethanothieno[2,3-b]pyridine-3-carboxylic acid, 2-[[2-(4-chlorophenoxy)acetyl]amino]-5,6-dihydro-, ethyl ester
AG-205/13866028SR-01000529244SR-01000529244-1Ethyl 2-[2-(4-chlorophenoxy)acetamido]-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylateethyl 4-[2-(4-chlorophenoxy)acetylamino]-5-thia-7-azatricyclo[5.2.2.0<2,6>]und eca-2(6),3-diene-3-carboxylateethyl 4-{[(4-chlorophenoxy)acetyl]amino}-3-thia-1-azatricyclo[5.2.2.0~2,6~]undeca-2(6),4-diene-5-carboxylate
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 579
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
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Compound notes
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