SDCCGMLS-0064802.P001
TL;DR: SDCCGMLS-0064802.P001 (CAS 164355-85-5) is a chemical compound with molecular formula C9H12N4O4 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5a-amino-7-methyl-3,6-dioxido-5,8-dihydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazole-3,6-diium-8a-ol
Also Known As: SDCCGMLS-0064802.P001, 8aH-Pyrrolo[3,2-e]-2,1,3-benzoxadiazol-8a-ol,5a-amino-4,5,5a,8-tetrahydro-7-methyl-,3,6-dioxide(9CI), 5a-amino-7-methyl-3,6-dioxido-5,8-dihydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazole-3,6-diium-8a-ol, 5a-amino-7-methyl-4,5,5a,8-tetrahydro-8aH-[1,2,5]oxadiazolo[3,4-e]indol-8a-ol 3,6-dioxide
| Molecular Formula | C9H12N4O4 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | -1.5283 |
| Topological Polar Surface Area | 125.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.08586 |
| Heavy Atoms | 17 |
| Complexity | 539.0982 |
Chemical Identifiers
| CAS Number | 164355-85-5 |
|---|---|
| SMILES | CC1=[N+](C2(CCC3=[N+](ON=C3C2(C1)O)[O-])N)[O-] |
Product Overview
SDCCGMLS-0064802.P001 (CAS 164355-85-5), with molecular formula C9H12N4O4 and molecular weight 240.09 g/mol. IUPAC: 5a-amino-7-methyl-3,6-dioxido-5,8-dihydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazole-3,6-diium-8a-ol.
Chemical Property Profile of SDCCGMLS-0064802.P001
Property Insights of SDCCGMLS-0064802.P001
The XLogP value of -1.5283 indicates that SDCCGMLS-0064802.P001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.29 Ų falls within the moderate polarity range, balancing permeability and solubility for SDCCGMLS-0064802.P001. Following Lipinski's Rule of Five, SDCCGMLS-0064802.P001 has 2 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 SDCCGMLS-0064802.P001?
The CAS number of SDCCGMLS-0064802.P001 is 164355-85-5.
What is the molecular formula of SDCCGMLS-0064802.P001?
The molecular formula of SDCCGMLS-0064802.P001 is C9H12N4O4.
What is the molecular weight of SDCCGMLS-0064802.P001?
The molecular weight of SDCCGMLS-0064802.P001 is 240.09 g/mol.
Where can I buy SDCCGMLS-0064802.P001?
You can request a quote for SDCCGMLS-0064802.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SDCCGMLS-0064802.P001?
Yes, KEHONG BIO provides custom synthesis services for SDCCGMLS-0064802.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.