BAS 00483378
TL;DR: BAS 00483378 (CAS 314022-36-1) is a chemical compound with molecular formula C19H16ClNO3S2 and molecular weight 405.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 00483378, methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, METHYL 2-(3-CHLORO-1-BENZOTHIOPHENE-2-AMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C19H16ClNO3S2 |
|---|---|
| Molecular Weight | 405.03 g/mol |
| LogP | 5.5339 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.026 |
| Heavy Atoms | 26 |
| Complexity | 1021.38306 |
Chemical Identifiers
| CAS Number | 314022-36-1 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
BAS 00483378 (CAS 314022-36-1), with molecular formula C19H16ClNO3S2 and molecular weight 405.03 g/mol. IUPAC: methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 00483378
Property Insights of BAS 00483378
The XLogP value of 5.5339 indicates that BAS 00483378 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 00483378 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00483378 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00483378?
The CAS number of BAS 00483378 is 314022-36-1.
What is the molecular formula of BAS 00483378?
The molecular formula of BAS 00483378 is C19H16ClNO3S2.
What is the molecular weight of BAS 00483378?
The molecular weight of BAS 00483378 is 405.03 g/mol.
Where can I buy BAS 00483378?
You can request a quote for BAS 00483378 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00483378?
Yes, KEHONG BIO provides custom synthesis services for BAS 00483378 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.