NCI60_036447
TL;DR: NCI60_036447 (CAS 214140-89-3) is a chemical compound with molecular formula C14H8Cl2N2O3S and molecular weight 353.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14,16-dichloro-18-oxa-4-thia-2,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(10),2,12(17),13,15-pentaene-9,11-dione
Also Known As: NCI60_036447, 9,11-dichloro-3,4-dihydro-2H,6H,7H-chromeno[2',3':4,5]pyrimido[2,1-b][1,3]thiazine-6,7-dione, 9,11-dichloro-3,4-dihydro-2H-chromeno[2',3':4,5]pyrimido[2,1-b][1,3]thiazine-6,7-dione
| Molecular Formula | C14H8Cl2N2O3S |
|---|---|
| Molecular Weight | 353.96 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 353.96326 |
| Heavy Atoms | 22 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 214140-89-3 |
|---|---|
| SMILES | C1CN2C(=O)C3=C(N=C2SC1)OC4=C(C3=O)C=C(C=C4Cl)Cl |
| InChIKey | UPIIQVLFEGVESV-UHFFFAOYSA-N |
Product Overview
NCI60_036447 (CAS 214140-89-3), with molecular formula C14H8Cl2N2O3S and molecular weight 353.96 g/mol. IUPAC: 14,16-dichloro-18-oxa-4-thia-2,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(10),2,12(17),13,15-pentaene-9,11-dione.
Chemical Property Profile of NCI60_036447
Property Insights of NCI60_036447
The XLogP value of 3.2 indicates that NCI60_036447 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_036447. Following Lipinski's Rule of Five, NCI60_036447 has 0 hydrogen bond donor(s) and 5 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 NCI60_036447?
The CAS number of NCI60_036447 is 214140-89-3.
What is the molecular formula of NCI60_036447?
The molecular formula of NCI60_036447 is C14H8Cl2N2O3S.
What is the molecular weight of NCI60_036447?
The molecular weight of NCI60_036447 is 353.96 g/mol.
Where can I buy NCI60_036447?
You can request a quote for NCI60_036447 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_036447?
Yes, KEHONG BIO provides custom synthesis services for NCI60_036447 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.