(6-Ethyl-thieno[2,3-d]pyrimidin-4-ylamino)-acetic acid
Basic information
- CAS
313534-29-1- Standard SMILES
CCc1cc2c(NCC(=O)O)ncnc2s1- InChIKey
AIRNYGCICDSLJX-UHFFFAOYSA-N- Molecular formula
- C10H11N3O2S
- Average molar mass
- 237.28 g/mol
- Monoisotopic mass
- 237.05719778
Names & identifiers
- Preferred name
- (6-Ethyl-thieno[2,3-d]pyrimidin-4-ylamino)-acetic acid
- IUPAC
- 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]acetic acid
- English name
- N-(6-Ethylthieno[2,3-d]pyrimidin-4-yl)glycine
- Molecular formula
- C10H11N3O2S
- Molecular weight
- 237.28
Names & synonyms
313534-29-1(6-Ethyl-thieno[2,3-d]pyrimidin-4-ylamino)-acetic acid2-((6-Ethylthieno[2,3-d]pyrimidin-4-yl)amino)acetic acid2-({6-ethylthieno[2,3-d]pyrimidin-4-yl}amino)acetic acidN-(6-Ethylthieno[2,3-d]pyrimidin-4-yl)glycine2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]acetic acidMFCD00652916F2117-00112-[(6-ethylthiopheno[3,2-e]pyrimidin-4-yl)amino]acetic acidOprea1_206150Oprea1_266962MLS000070516
Show more names
2-((6-Ethylthieno[2,3-d]pyrimidin-4-yl)Glycine, N-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]aceticaci
CHEMBL14170412-((6-Ethylthieno[2,3-d]pyrimidin-4-yl)amino)aceticacidDTXSID30349499HMS2291D13SMSSF-0045391SBB011759AKOS000301348AS-66847
Database identifiers
- CAS
313534-29-1- PubChem CID
- 650309
- DTXSID
DTXSID30349499- ChEMBL
CHEMBL1417041
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Density
- 1.456 · 1.456
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 29335990 · 29335990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 29335990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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