(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone

C15H8Br2OS — CID 115784083

IUPAC(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone
SMILESO=C(c1ccc2cc(Br)ccc2c1)c1cscc1Br
InChIInChI=1S/C15H8Br2OS/c16-12-4-3-9-5-11(2-1-10(9)6-12)15(18)13-7-19-8-14(13)17/h1-8H
InChIKeyYSLMORFXPBAIHG-UHFFFAOYSA-N
MW396.10 g/mol
LogP5.66
Rot. Bonds2

About (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone

(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone (PubChem CID 115784083) has the molecular formula C15H8Br2OS and a molecular weight of 396.10 g/mol. Its IUPAC name is (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone.

Molecular Properties

Compound Name(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone
PubChem CID115784083
Molecular FormulaC15H8Br2OS
Molecular Weight396.10 g/mol
Exact Mass393.87
IUPAC Name(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone
SMILESO=C(c1ccc2cc(Br)ccc2c1)c1cscc1Br
InChIInChI=1S/C15H8Br2OS/c16-12-4-3-9-5-11(2-1-10(9)6-12)15(18)13-7-19-8-14(13)17/h1-8H
InChIKeyYSLMORFXPBAIHG-UHFFFAOYSA-N
XLogP5.66
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.10
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone 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

(3-bromophenyl)-(4-bromothiophen-3-yl)methanone
CID 10831406
(3-bromo-4-fluorophenyl)-(4-bromothiophen-3-yl)methanone
CID 82808642
(4-bromothiophen-3-yl)-(4-iodophenyl)methanone
CID 115784171
(4-bromothiophen-3-yl)-(3-chloro-4-fluorophenyl)methanone
CID 79596049
(6-bromonaphthalen-2-yl)-(4-methyl-3-pyridinyl)methanone
CID 115781346
(4-bromothiophen-3-yl)-[4-(trifluoromethyl)phenyl]methanone
CID 115784148
[6-(2-bromobenzoyl)naphthalen-2-yl]-(2-bromophenyl)methanone
CID 139602741
(5-bromo-2-chlorophenyl)-naphthalen-2-ylmethanone
CID 114970356
(4-bromothiophen-3-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 79595938
(6-bromonaphthalen-2-yl)-(cyclohexen-1-yl)methanone
CID 115353718
(4-bromophenyl)-(4-methylthiophen-3-yl)methanone
CID 79803148
1-(7-bromonaphthalen-2-yl)ethanone
CID 68758171

Frequently Asked Questions

What is the IUPAC name of (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone?
The IUPAC name of (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone (CID 115784083) is (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone.
What is the SMILES notation for (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone?
The canonical SMILES for (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone is O=C(c1ccc2cc(Br)ccc2c1)c1cscc1Br.
What is the InChIKey of (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone?
The InChIKey is YSLMORFXPBAIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Br2OS/c16-12-4-3-9-5-11(2-1-10(9)6-12)15(18)13-7-19-8-14(13)17/h1-8H.
What are the key properties of (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone?
(6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone has a molecular weight of 396.10 g/mol, XLogP of 5.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromonaphthalen-2-yl)-(4-bromothiophen-3-yl)methanone is sourced from PubChem (CID 115784083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).