![5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide structure](/static/products/4382/438237-08-2.webp)
5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide
TL;DR: 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide (CAS 438237-08-2) is a chemical compound with molecular formula C18H17ClN6O6S and molecular weight 480.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide
Also Known As: 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide, 5-CHLORO-N-{3-[(2,3-DIHYDROXYPROPYL)SULFANYL]-5-NITROPHENYL}-2-METHOXY-4-(1H-1,2,3,4-TETRAAZOL-1-YL)BENZAMIDE, 5-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-2-methoxy-4-(1H-tetraazol-1-yl)benzamide, 5-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-2-methoxy-4-(1H-tetrazol-1-yl)benzamide
| Molecular Formula | C18H17ClN6O6S |
|---|---|
| Molecular Weight | 480.06 g/mol |
| LogP | 1.9301 |
| Topological Polar Surface Area | 165.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.0619 |
| Heavy Atoms | 32 |
| Complexity | 1129.398 |
Chemical Identifiers
| CAS Number | 438237-08-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)NC2=CC(=CC(=C2)SCC(CO)O)[N+](=O)[O-])Cl)N3C=NN=N3 |
Product Overview
5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide (CAS 438237-08-2), with molecular formula C18H17ClN6O6S and molecular weight 480.06 g/mol. IUPAC: 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide.
Chemical Property Profile of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide
Property Insights of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide
The XLogP value of 1.9301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide. The TPSA of 165.53 Ų indicates high polarity, suggesting 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide has 3 hydrogen bond donor(s) and 10 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 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide?
The CAS number of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide is 438237-08-2.
What is the molecular formula of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide?
The molecular formula of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide is C18H17ClN6O6S.
What is the molecular weight of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide?
The molecular weight of 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide is 480.06 g/mol.
Where can I buy 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide?
You can request a quote for 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]-2-methoxy-4-(tetrazol-1-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.