BAS 00487074
TL;DR: BAS 00487074 (CAS 329067-11-0) is a chemical compound with molecular formula C19H15BrN2O2S2 and molecular weight 445.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-(thiophene-2-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Also Known As: BAS 00487074, N-(4-bromophenyl)-2-(thiophene-2-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide, N-(4-bromophenyl)-2-[(2-thienylcarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide, N-(4-bromophenyl)[2-(2-thienylcarbonylamino)(4,5,6-trihydrocyclopenta[1,2-b]th iophen-3-yl)]carboxamide, N-(4-bromophenyl)-2-[(thiophen-2-ylcarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
| Molecular Formula | C19H15BrN2O2S2 |
|---|---|
| Molecular Weight | 445.98 g/mol |
| LogP | 5.5654 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.97583 |
| Heavy Atoms | 26 |
| Complexity | 962.348 |
Chemical Identifiers
| CAS Number | 329067-11-0 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Br)NC(=O)C4=CC=CS4 |
Product Overview
BAS 00487074 (CAS 329067-11-0), with molecular formula C19H15BrN2O2S2 and molecular weight 445.98 g/mol. IUPAC: N-(4-bromophenyl)-2-(thiophene-2-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide.
Chemical Property Profile of BAS 00487074
Property Insights of BAS 00487074
The XLogP value of 5.5654 indicates that BAS 00487074 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, BAS 00487074 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00487074 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00487074?
The CAS number of BAS 00487074 is 329067-11-0.
What is the molecular formula of BAS 00487074?
The molecular formula of BAS 00487074 is C19H15BrN2O2S2.
What is the molecular weight of BAS 00487074?
The molecular weight of BAS 00487074 is 445.98 g/mol.
Where can I buy BAS 00487074?
You can request a quote for BAS 00487074 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00487074?
Yes, KEHONG BIO provides custom synthesis services for BAS 00487074 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.