BAS 03080751
TL;DR: BAS 03080751 (CAS 329227-51-2) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetic acid
Also Known As: BAS 03080751, SDCCGSBI-0660973.P001, AB00113626-01, (7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetic acid, AF-399/40713920
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.6674 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 716.482 |
Chemical Identifiers
| CAS Number | 329227-51-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC(=O)O |
Product Overview
BAS 03080751 (CAS 329227-51-2), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetic acid.
Chemical Property Profile of BAS 03080751
Property Insights of BAS 03080751
The XLogP value of 1.6674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03080751. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03080751. Following Lipinski's Rule of Five, BAS 03080751 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 03080751?
The CAS number of BAS 03080751 is 329227-51-2.
What is the molecular formula of BAS 03080751?
The molecular formula of BAS 03080751 is C13H14N2O3S.
What is the molecular weight of BAS 03080751?
The molecular weight of BAS 03080751 is 278.07 g/mol.
Where can I buy BAS 03080751?
You can request a quote for BAS 03080751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03080751?
Yes, KEHONG BIO provides custom synthesis services for BAS 03080751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.