Basic information
- CAS
185430-52-8- Standard SMILES
COCc1cc(C)nc2sc(C(N)=O)c(N)c12- InChIKey
IHMBNOOUSWWUFM-UHFFFAOYSA-N- Molecular formula
- C11H13N3O2S
- Average molar mass
- 251.31 g/mol
- Monoisotopic mass
- 251.07284784
Names & identifiers
- Preferred name
- 3-Amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
- IUPAC
- 3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
Names & synonyms
3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide185430-52-8DTXSID003515843-Amino-4-(methoxymethyl)-6-methylthieno(2,3-b)pyridine-2-carboxamideRefChem:276453DTXCID80302650800-690-0ChemDiv3_004184Oprea1_289235SCHEMBL4191436CHEMBL4780986BDBM576463
Show more names
HMS1484O04STK283224US11471446, Compound DBA-4AKOS000103370IDI1_022094NCGC00178607-01DB-183230ST50304270
Database identifiers
- CAS
185430-52-8- PubChem CID
- 704064
- DTXSID
DTXSID00351584- ChEMBL
CHEMBL4780986- EC Number
- 800-690-0
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 302
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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