C14H15N3O5S
TL;DR: C14H15N3O5S (CAS 903854-85-3) is a chemical compound with molecular formula C14H15N3O5S and molecular weight 337.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[9-(2-amino-2-oxoethyl)-10,12-dioxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-dien-11-yl]acetate
Also Known As: methyl 2-(1-(2-amino-2-oxoethyl)-2,4-dioxo-6,7-dihydro-1H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(2H,4H,5H)-yl)acetate, methyl [1-(2-amino-2-oxoethyl)-2,4-dioxo-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
| Molecular Formula | C14H15N3O5S |
|---|---|
| Molecular Weight | 337.07 g/mol |
| LogP | -0.6283 |
| Topological Polar Surface Area | 113.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.07324 |
| Heavy Atoms | 23 |
| Complexity | 936.50653 |
Chemical Identifiers
| CAS Number | 903854-85-3 |
|---|---|
| SMILES | COC(=O)CN1C(=O)C2=C(N(C1=O)CC(=O)N)SC3=C2CCC3 |
Product Overview
C14H15N3O5S (CAS 903854-85-3), with molecular formula C14H15N3O5S and molecular weight 337.07 g/mol. IUPAC: methyl 2-[9-(2-amino-2-oxoethyl)-10,12-dioxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-dien-11-yl]acetate.
Chemical Property Profile of C14H15N3O5S
Property Insights of C14H15N3O5S
The XLogP value of -0.6283 indicates that C14H15N3O5S is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.39 Ų falls within the moderate polarity range, balancing permeability and solubility for C14H15N3O5S. Following Lipinski's Rule of Five, C14H15N3O5S has 1 hydrogen bond donor(s) and 6 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 C14H15N3O5S?
The CAS number of C14H15N3O5S is 903854-85-3.
What is the molecular formula of C14H15N3O5S?
The molecular formula of C14H15N3O5S is C14H15N3O5S.
What is the molecular weight of C14H15N3O5S?
The molecular weight of C14H15N3O5S is 337.07 g/mol.
Where can I buy C14H15N3O5S?
You can request a quote for C14H15N3O5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14H15N3O5S?
Yes, KEHONG BIO provides custom synthesis services for C14H15N3O5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.