DH 6471
TL;DR: DH 6471 (CAS 76871-95-9) is a chemical compound with molecular formula C12H14ClN3OS and molecular weight 283.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-thia-10,12,15-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-13-one;hydrochloride
Also Known As: DH 6471, 1,2,3,5,6,7,8,9-Octahydro(1)benzothieno(2,3-d)imidazo(1,2-a)pyrimidin-2-one hydrochloride, (1)Benzothieno(2,3-d)imidazo(1,2-a)pyrimidin-2(3H)-one, 1,5,6,7,8,9-hexahydro-, monohydrochloride, 8-thia-10,12,15-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-13-one;hydrochloride, [1]Benzothieno[2,3-d]imidazo[1,2-a]pyrimidin-2(3H)-one, 1,5,6,7,8,9-hexahydro-, monohydrochloride
| Molecular Formula | C12H14ClN3OS |
|---|---|
| Molecular Weight | 283.05 g/mol |
| LogP | 1.9816 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 283.0546 |
| Heavy Atoms | 18 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 76871-95-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C4NC(=O)CN4C3.Cl |
| InChIKey | XXLYIUKAFIEFHW-UHFFFAOYSA-N |
Product Overview
DH 6471 (CAS 76871-95-9), with molecular formula C12H14ClN3OS and molecular weight 283.05 g/mol. IUPAC: 8-thia-10,12,15-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-13-one;hydrochloride.
Chemical Property Profile of DH 6471
Property Insights of DH 6471
The XLogP value of 1.9816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DH 6471. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for DH 6471. Following Lipinski's Rule of Five, DH 6471 has 2 hydrogen bond donor(s) and 3 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 DH 6471?
The CAS number of DH 6471 is 76871-95-9.
What is the molecular formula of DH 6471?
The molecular formula of DH 6471 is C12H14ClN3OS.
What is the molecular weight of DH 6471?
The molecular weight of DH 6471 is 283.05 g/mol.
Where can I buy DH 6471?
You can request a quote for DH 6471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DH 6471?
Yes, KEHONG BIO provides custom synthesis services for DH 6471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.