5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine

C10H8Cl2N2S2 — CID 121215660

IUPAC5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1Sc1cc(Cl)ccc1Cl
InChIInChI=1S/C10H8Cl2N2S2/c1-5-9(16-10(13)14-5)15-8-4-6(11)2-3-7(8)12/h2-4H,1H3,(H2,13,14)
InChIKeyLCOBXBWYQRUJMC-UHFFFAOYSA-N
MW291.23 g/mol
LogP4.49
Rot. Bonds2

About 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine

5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine (PubChem CID 121215660) has the molecular formula C10H8Cl2N2S2 and a molecular weight of 291.23 g/mol. Its IUPAC name is 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine
PubChem CID121215660
Molecular FormulaC10H8Cl2N2S2
Molecular Weight291.23 g/mol
Exact Mass289.95
IUPAC Name5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1Sc1cc(Cl)ccc1Cl
InChIInChI=1S/C10H8Cl2N2S2/c1-5-9(16-10(13)14-5)15-8-4-6(11)2-3-7(8)12/h2-4H,1H3,(H2,13,14)
InChIKeyLCOBXBWYQRUJMC-UHFFFAOYSA-N
XLogP4.49
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.23
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,4-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine
CID 121215661
5-[(4-chloro-2-fluorophenyl)methylsulfanyl]-4-methyl-1,3-thiazol-2-amine
CID 114849686
5-chloro-2-(2,5-dichlorophenyl)sulfanylaniline
CID 29298573
6-(2,5-dichlorophenyl)sulfanyl-4-methylpyridin-3-amine
CID 79176848
5-(2,5-dichlorophenyl)sulfanyl-1-ethyl-3-methylpyrazol-4-amine
CID 66010943
2-cyclopropyl-6-(2,5-dichlorophenyl)sulfanyl-5-methylpyrimidin-4-amine
CID 80990216
2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 63944797
[4-(2,5-dichlorophenyl)sulfanyl-6-methylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336532
6-(2,5-dichlorophenyl)sulfanyl-5-methyl-2-propylpyrimidin-4-amine
CID 80989994
4-chloro-6-(2,5-dichlorophenyl)sulfanyl-2-methylpyrimidine-5-carbaldehyde
CID 80726765
4-(2,4-dichlorophenyl)-5-propan-2-yl-1,3-thiazol-2-amine
CID 28864558
4-chloro-6-(2,5-dichlorophenyl)sulfanyl-2-ethyl-5-methylpyrimidine
CID 80978191

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine (CID 121215660) is 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine is Cc1nc(N)sc1Sc1cc(Cl)ccc1Cl.
What is the InChIKey of 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine?
The InChIKey is LCOBXBWYQRUJMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2S2/c1-5-9(16-10(13)14-5)15-8-4-6(11)2-3-7(8)12/h2-4H,1H3,(H2,13,14).
What are the key properties of 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine?
5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine has a molecular weight of 291.23 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dichlorophenyl)sulfanyl-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 121215660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).