N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine

C15H10BrClN2S — CID 3551547

IUPACN-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
SMILESClc1ccc(-c2csc(Nc3ccc(Br)cc3)n2)cc1
InChIInChI=1S/C15H10BrClN2S/c16-11-3-7-13(8-4-11)18-15-19-14(9-20-15)10-1-5-12(17)6-2-10/h1-9H,(H,18,19)
InChIKeyDDEUPRJNRRVNPF-UHFFFAOYSA-N
MW365.68 g/mol
LogP5.97
Rot. Bonds3

About N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine

N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine (PubChem CID 3551547) has the molecular formula C15H10BrClN2S and a molecular weight of 365.68 g/mol. Its IUPAC name is N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
PubChem CID3551547
Molecular FormulaC15H10BrClN2S
Molecular Weight365.68 g/mol
Exact Mass363.94
IUPAC NameN-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
SMILESClc1ccc(-c2csc(Nc3ccc(Br)cc3)n2)cc1
InChIInChI=1S/C15H10BrClN2S/c16-11-3-7-13(8-4-11)18-15-19-14(9-20-15)10-1-5-12(17)6-2-10/h1-9H,(H,18,19)
InChIKeyDDEUPRJNRRVNPF-UHFFFAOYSA-N
XLogP5.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.68
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-(4-iodophenyl)-1,3-thiazol-2-amine
CID 2193688
[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol
CID 118713961
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]benzamide
CID 46880290
4-(4-bromophenyl)-N-(2,4,6-trichlorophenyl)-1,3-thiazol-2-amine
CID 151197403
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
1-[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]ethanone
CID 84564240
4-(4-bromophenyl)-N-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-amine
CID 142697325
N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine
CID 4683115
4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 53338312
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]-N-methylbenzamide
CID 46880291
1-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-N,4-N-diethylbenzene-1,4-diamine;hydrobromide
CID 2877699

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine (CID 3551547) is N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine is Clc1ccc(-c2csc(Nc3ccc(Br)cc3)n2)cc1.
What is the InChIKey of N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine?
The InChIKey is DDEUPRJNRRVNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2S/c16-11-3-7-13(8-4-11)18-15-19-14(9-20-15)10-1-5-12(17)6-2-10/h1-9H,(H,18,19).
What are the key properties of N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine?
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine has a molecular weight of 365.68 g/mol, XLogP of 5.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 3551547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).