[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol

C16H13ClN2OS — CID 118713961

IUPAC[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol
SMILESOCc1ccc(Nc2nc(-c3ccc(Cl)cc3)cs2)cc1
InChIInChI=1S/C16H13ClN2OS/c17-13-5-3-12(4-6-13)15-10-21-16(19-15)18-14-7-1-11(9-20)2-8-14/h1-8,10,20H,9H2,(H,18,19)
InChIKeyFANPWGUETFAUJV-UHFFFAOYSA-N
MW316.81 g/mol
LogP4.70
Rot. Bonds4

About [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol

[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol (PubChem CID 118713961) has the molecular formula C16H13ClN2OS and a molecular weight of 316.81 g/mol. Its IUPAC name is [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol.

Molecular Properties

Compound Name[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol
PubChem CID118713961
Molecular FormulaC16H13ClN2OS
Molecular Weight316.81 g/mol
Exact Mass316.04
IUPAC Name[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol
SMILESOCc1ccc(Nc2nc(-c3ccc(Cl)cc3)cs2)cc1
InChIInChI=1S/C16H13ClN2OS/c17-13-5-3-12(4-6-13)15-10-21-16(19-15)18-14-7-1-11(9-20)2-8-14/h1-8,10,20H,9H2,(H,18,19)
InChIKeyFANPWGUETFAUJV-UHFFFAOYSA-N
XLogP4.70
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.81
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol with MolForge

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Related Compounds

N-(4-chlorophenyl)-4-(4-iodophenyl)-1,3-thiazol-2-amine
CID 2193688
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 3551547
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]benzamide
CID 46880290
1-[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]ethanone
CID 84564240
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]-N-methylbenzamide
CID 46880291
2-[4-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]ethanol
CID 71814305
4-(4-chlorophenyl)-N-(6-chloro-3-pyridinyl)-1,3-thiazol-2-amine
CID 166340316
4-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
CID 4149421
4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 53338312
3-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenol
CID 877802
4-[2-[4-(hydroxymethyl)anilino]-1,3-thiazol-4-yl]benzene-1,3-diol
CID 126613345
4-(4-chlorophenyl)-N-(4-morpholin-4-ylphenyl)-1,3-thiazol-2-amine
CID 118708824

Frequently Asked Questions

What is the IUPAC name of [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol?
The IUPAC name of [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol (CID 118713961) is [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol.
What is the SMILES notation for [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol?
The canonical SMILES for [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol is OCc1ccc(Nc2nc(-c3ccc(Cl)cc3)cs2)cc1.
What is the InChIKey of [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol?
The InChIKey is FANPWGUETFAUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2OS/c17-13-5-3-12(4-6-13)15-10-21-16(19-15)18-14-7-1-11(9-20)2-8-14/h1-8,10,20H,9H2,(H,18,19).
What are the key properties of [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol?
[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol has a molecular weight of 316.81 g/mol, XLogP of 4.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol is sourced from PubChem (CID 118713961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).