N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine

C19H12Br2N2OS — CID 4683115

IUPACN-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine
SMILESBrc1ccc(Nc2nc(-c3ccc(-c4ccc(Br)cc4)o3)cs2)cc1
InChIInChI=1S/C19H12Br2N2OS/c20-13-3-1-12(2-4-13)17-9-10-18(24-17)16-11-25-19(23-16)22-15-7-5-14(21)6-8-15/h1-11H,(H,22,23)
InChIKeyUXWSMUCLRMEKKB-UHFFFAOYSA-N
MW476.19 g/mol
LogP7.34
Rot. Bonds4

About N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine

N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine (PubChem CID 4683115) has the molecular formula C19H12Br2N2OS and a molecular weight of 476.19 g/mol. Its IUPAC name is N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine
PubChem CID4683115
Molecular FormulaC19H12Br2N2OS
Molecular Weight476.19 g/mol
Exact Mass473.90
IUPAC NameN-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine
SMILESBrc1ccc(Nc2nc(-c3ccc(-c4ccc(Br)cc4)o3)cs2)cc1
InChIInChI=1S/C19H12Br2N2OS/c20-13-3-1-12(2-4-13)17-9-10-18(24-17)16-11-25-19(23-16)22-15-7-5-14(21)6-8-15/h1-11H,(H,22,23)
InChIKeyUXWSMUCLRMEKKB-UHFFFAOYSA-N
XLogP7.34
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.19
LogP ≤ 57.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[5-(4-bromophenyl)furan-2-yl]-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 3280663
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 3551547
1-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-N,4-N-diethylbenzene-1,4-diamine;hydrobromide
CID 2877699
N-(4-bromophenyl)-4-(4-imidazol-1-ylphenyl)-1,3-thiazol-2-amine
CID 58910449
N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2840600
N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine
CID 22347320
4-(4-bromophenyl)-N-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-amine
CID 142697325
4-(5-bromofuran-2-yl)-2-(4-bromophenyl)-1,3-thiazole
CID 113437726
4-[4-[(4-bromophenyl)methoxy]phenyl]-N-phenyl-1,3-thiazol-2-amine
CID 3100458
[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
CID 90481496
4-(4-bromophenyl)-N-(4,6-dimethylpyrimidin-2-yl)-1,3-thiazol-2-amine
CID 1211245
N-[[5-[2-(4-methylanilino)-1,3-thiazol-4-yl]furan-2-yl]methyl]acetamide
CID 31978588

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine?
The IUPAC name of N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine (CID 4683115) is N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine is Brc1ccc(Nc2nc(-c3ccc(-c4ccc(Br)cc4)o3)cs2)cc1.
What is the InChIKey of N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine?
The InChIKey is UXWSMUCLRMEKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Br2N2OS/c20-13-3-1-12(2-4-13)17-9-10-18(24-17)16-11-25-19(23-16)22-15-7-5-14(21)6-8-15/h1-11H,(H,22,23).
What are the key properties of N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine?
N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine has a molecular weight of 476.19 g/mol, XLogP of 7.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 4683115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).