AC1MD4EJ
ethyl 9-oxo-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16)-triene-4-carboxylate
Also Known As: TimTec1_001078|Oprea1_477924|Oprea1_873811|BAS 00584476|NCGC00057294-02|NCGC00057294-03|NCGC00174816-01|ethyl 12-oxo-1,2,3,4,7,9,10,12-octahydro-8H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylate|AH-262/32338013|SR-01000454832-1|BRD-A45401072-001-01-5|BRD-A45401072-001-08-0|Ethyl 12-oxo-1,2,3,4,7,9,10,12-octahydro-8H-benzo[4,5]thieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylate|ETHYL 9-OXO-17-THIA-2,8-DIAZATETRACYCLO[8.7.0.0(3),?.0(1)(1),(1)?]HEPTADECA-1(10),2,11(16)-TRIENE-4-CARBOXYLATE|Ethyl 9-oxo-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16)-triene-4-carboxylate|ethyl 9-oxo-17-thia-2,8-diazatetracyclo[8.7.0.0(3),.0(1)(1),(1)]heptadeca-1(10),2,11(16)-triene-4-carboxylate|1,2,3,4,7,9,10,12-Octahydro-12-oxo-8H-[1]-benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylic acid ethyl ester|1,2,3,4,7,9,10,12-Octahydro-12-oxo-8H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylic acid ethyl ester|ethyl 12-oxo-1,2,3,4,11-pentahydrobenzo[b]thiopheno[2,3-d]piperidino[1,2-a]pyr imidine-7-carboxylate|ethyl 12-oxo-2,3,4,7,8,9,10,12-octahydro-1H-benzo[4,5]thieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylate
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.11948 g/mol |
| LogP | 2.7773 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.11948 |
| Monoisotopic Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 836.45654 |
Chemical Identifiers
| CAS Number | 329059-69-0 |
|---|---|
| SMILES | CCOC(=O)C1CCCN2C1=NC3=C(C2=O)C4=C(S3)CCCC4 |
Product Overview
AC1MD4EJ (CAS 329059-69-0), with molecular formula C17H20N2O3S and molecular weight 332.11948 g/mol. IUPAC: ethyl 9-oxo-17-thia-2,8-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,11(16)-triene-4-carboxylate.
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