BAS 05290564
TL;DR: BAS 05290564 (CAS 433699-92-4) is a chemical compound with molecular formula C16H21N3O3S2 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]butanamide
Also Known As: BAS 05290564, N-(3-hydroxypropyl)-4-((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)butanamide, N-(3-hydroxypropyl)-4-[(1-oxo-2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-3-yl)thio]butanamide, N-(3-Hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]butanamide, N-(3-hydroxypropyl)-4-[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]butanamide
| Molecular Formula | C16H21N3O3S2 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 1.8442 |
| Topological Polar Surface Area | 95.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 367.10245 |
| Heavy Atoms | 24 |
| Complexity | 784.701 |
Chemical Identifiers
| CAS Number | 433699-92-4 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)NC(=N3)SCCCC(=O)NCCCO |
Product Overview
BAS 05290564 (CAS 433699-92-4), with molecular formula C16H21N3O3S2 and molecular weight 367.10 g/mol. IUPAC: N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]butanamide.
Chemical Property Profile of BAS 05290564
Property Insights of BAS 05290564
The XLogP value of 1.8442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05290564. The TPSA of 95.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05290564. Following Lipinski's Rule of Five, BAS 05290564 has 3 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 BAS 05290564?
The CAS number of BAS 05290564 is 433699-92-4.
What is the molecular formula of BAS 05290564?
The molecular formula of BAS 05290564 is C16H21N3O3S2.
What is the molecular weight of BAS 05290564?
The molecular weight of BAS 05290564 is 367.10 g/mol.
Where can I buy BAS 05290564?
You can request a quote for BAS 05290564 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05290564?
Yes, KEHONG BIO provides custom synthesis services for BAS 05290564 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.