Basic information
- CAS
13988-28-8- Standard SMILES
CCN(CC)CCNc1ccc(C)c2sc3nc(C)cc(C)c3c(=O)c12- InChIKey
CYJKCTSECWDKKL-UHFFFAOYSA-N- Molecular formula
- C21H27N3OS
- Average molar mass
- 369.5 g/mol
- Monoisotopic mass
- 369.18748367
Names & identifiers
- Preferred name
- 6-(2-Diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno[2,3-b]pyridin-5-one
- IUPAC
- 6-[2-(diethylamino)ethylamino]-2,4,9-trimethylthiochromeno[2,3-b]pyridin-5-one
- English name
- 6-(2-diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno[2,3-b]pyridin-5-one
- Molecular formula
- C21H27N3OS
- Molecular weight
- 369.52358
Names & synonyms
13988-28-86-(2-diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno[2,3-b]pyridin-5-one6-(2-Diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno(2,3-b)pyridin-5-oneEINECS 237-785-6CYJKCTSECWDKKL-UHFFFAOYSA-NDTXSID201611826-[2-(diethylamino)ethylamino]-2,4,9-trimethylthiochromeno[2,3-b]pyridin-5-oneNS000245256-{[2-(Diethylamino)ethyl]amino}-2,4,9-trimethyl-5H-[1]benzothiopyrano[2,3-b]pyridin-5-one6-[[2-(Diethylamino)ethyl]amino]-2,4,9-trimethyl-5H-[1]benzothiopyrano[2,3-b]pyridin-5-one5H-[1]Benzothiopyrano[2,3-b]pyridin-5-one, 6-[[2-(diethylamino)ethyl]amino]-2,4,9-trimethyl-
Database identifiers
- CAS
13988-28-8- PubChem CID
- 84136
- DTXSID
DTXSID20161182- EC Number
- 237-785-6
- Nikkaji
- J216.806E
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 484
Chemistry & industry
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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