SC 42867
TL;DR: SC 42867 (CAS 102251-91-2) is a chemical compound with molecular formula C19H20ClN3O5S and molecular weight 437.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N'-(3-ethylsulfonylpropanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide
Also Known As: Dibenz(b,f)(1,4)oxazepine-10(11H)-carboxylic acid, 8-chloro-, 2-(3-(ethylsulfonyl)-1-oxopropyl)hydrazide, 3-chloro-N'-(3-ethylsulfonylpropanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide, 8-chloro-N'-(3-(ethylsulfonyl)propanoyl)dibenzo[b,f][1,4]oxazepine-10(11H)-carbohydrazide, 6-chloro-N'-[3-(ethanesulfonyl)propanoyl]-2-oxa-9-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-9-carbohydrazide, 8-Chloro-N'-[3-(ethanesulfonyl)propanoyl]dibenzo[b,f][1,4]oxazepine-10(11H)-carbohydrazide
| Molecular Formula | C19H20ClN3O5S |
|---|---|
| Molecular Weight | 437.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.0812 |
| Heavy Atoms | 29 |
| Complexity | 698.0 |
Chemical Identifiers
| CAS Number | 102251-91-2 |
|---|---|
| SMILES | CCS(=O)(=O)CCC(=O)NNC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl |
| InChIKey | MKWZNWIFSJUXCI-UHFFFAOYSA-N |
Product Overview
SC 42867 (CAS 102251-91-2), with molecular formula C19H20ClN3O5S and molecular weight 437.08 g/mol. IUPAC: 3-chloro-N'-(3-ethylsulfonylpropanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide.
Chemical Property Profile of SC 42867
Property Insights of SC 42867
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SC 42867. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SC 42867. Following Lipinski's Rule of Five, SC 42867 has 2 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 SC 42867?
The CAS number of SC 42867 is 102251-91-2.
What is the molecular formula of SC 42867?
The molecular formula of SC 42867 is C19H20ClN3O5S.
What is the molecular weight of SC 42867?
The molecular weight of SC 42867 is 437.08 g/mol.
Where can I buy SC 42867?
You can request a quote for SC 42867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SC 42867?
Yes, KEHONG BIO provides custom synthesis services for SC 42867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.