![3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide structure](/static/products/4382/438223-44-0.webp)
3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide
TL;DR: 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide (CAS 438223-44-0) is a chemical compound with molecular formula C12H15ClN2O5S and molecular weight 334.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]propanamide
Also Known As: 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide, 3-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]propanamide
| Molecular Formula | C12H15ClN2O5S |
|---|---|
| Molecular Weight | 334.04 g/mol |
| LogP | 1.6075 |
| Topological Polar Surface Area | 112.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 334.03903 |
| Heavy Atoms | 21 |
| Complexity | 514.4212 |
Chemical Identifiers
| CAS Number | 438223-44-0 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])SCC(CO)O)NC(=O)CCCl |
Product Overview
3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide (CAS 438223-44-0), with molecular formula C12H15ClN2O5S and molecular weight 334.04 g/mol. IUPAC: 3-chloro-N-[3-(2,3-dihydroxypropylsulfanyl)-5-nitrophenyl]propanamide.
Chemical Property Profile of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide
Property Insights of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide
The XLogP value of 1.6075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide. The TPSA of 112.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide. Following Lipinski's Rule of Five, 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide 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 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide?
The CAS number of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide is 438223-44-0.
What is the molecular formula of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide?
The molecular formula of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide is C12H15ClN2O5S.
What is the molecular weight of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide?
The molecular weight of 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide is 334.04 g/mol.
Where can I buy 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide?
You can request a quote for 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.