[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol

C8H4ClF3N2OS — CID 177236614

IUPAC[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol
SMILESOCc1cc2nc(Cl)c(C(F)(F)F)nc2s1
InChIInChI=1S/C8H4ClF3N2OS/c9-6-5(8(10,11)12)14-7-4(13-6)1-3(2-15)16-7/h1,15H,2H2
InChIKeyJZVCSORPASBOMQ-UHFFFAOYSA-N
MW268.65 g/mol
LogP2.86
Rot. Bonds1

About [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol

[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol (PubChem CID 177236614) has the molecular formula C8H4ClF3N2OS and a molecular weight of 268.65 g/mol. Its IUPAC name is [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol.

Molecular Properties

Compound Name[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol
PubChem CID177236614
Molecular FormulaC8H4ClF3N2OS
Molecular Weight268.65 g/mol
Exact Mass267.97
IUPAC Name[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol
SMILESOCc1cc2nc(Cl)c(C(F)(F)F)nc2s1
InChIInChI=1S/C8H4ClF3N2OS/c9-6-5(8(10,11)12)14-7-4(13-6)1-3(2-15)16-7/h1,15H,2H2
InChIKeyJZVCSORPASBOMQ-UHFFFAOYSA-N
XLogP2.86
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.65
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazine-6-carboxylate
CID 177236659
3,5-dibromo-2-chloro-6-(trifluoromethyl)pyridine
CID 124849965
2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline
CID 123460258
[5-chloro-6-(trifluoromethyl)pyrazin-2-yl]methanamine
CID 83848889
(5-chloro-1-benzothiophen-2-yl)methanol
CID 23340421
[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118839527
[3,5-dichloro-2-(trifluoromethyl)-4-pyridinyl]methanol
CID 170906648
sodium;boranuide;[2-chloro-6-(trifluoromethyl)-4-pyridinyl]methanol
CID 160647175
[6-chloro-2-cyclopropyl-3-(trifluoromethyl)-4-pyridinyl]methanol
CID 122455803
3,4,6-trichloro-2-(trifluoromethyl)pyridine
CID 171506095
[2-chloro-4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methanol
CID 131866706
(5-fluoro-1-benzothiophen-2-yl)methanol
CID 36995594

Frequently Asked Questions

What is the IUPAC name of [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol?
The IUPAC name of [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol (CID 177236614) is [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol.
What is the SMILES notation for [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol?
The canonical SMILES for [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol is OCc1cc2nc(Cl)c(C(F)(F)F)nc2s1.
What is the InChIKey of [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol?
The InChIKey is JZVCSORPASBOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4ClF3N2OS/c9-6-5(8(10,11)12)14-7-4(13-6)1-3(2-15)16-7/h1,15H,2H2.
What are the key properties of [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol?
[2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol has a molecular weight of 268.65 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazin-6-yl]methanol is sourced from PubChem (CID 177236614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).