SQ 10996
TL;DR: SQ 10996 (CAS 16802-77-0) is a chemical compound with molecular formula C14H11ClN2O2 and molecular weight 274.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6H-benzo[c][1,5]benzoxazepine-11-carboxamide
Also Known As: 2-chloro-6H-benzo[c][1,5]benzoxazepine-11-carboxamide, Dibenz(b,e)(1,4)oxazepine-5(11H)-carboxamide, 7-chloro-, 7-Chlorodibenz(b,e)(1,4)oxazepine-5(11H)-carboxamide, 7-Chlorodibenz[b,e][1,4]oxazepine-5(11H)-carboxamide, 7-chlorodibenzo[b,e][1,4]oxazepine-5(11H)-carboxamide
| Molecular Formula | C14H11ClN2O2 |
|---|---|
| Molecular Weight | 274.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 274.0509 |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 16802-77-0 |
|---|---|
| SMILES | C1C2=CC=CC=C2N(C3=C(O1)C=CC(=C3)Cl)C(=O)N |
| InChIKey | QAAMRPKLZCOAAY-UHFFFAOYSA-N |
Product Overview
SQ 10996 (CAS 16802-77-0), with molecular formula C14H11ClN2O2 and molecular weight 274.05 g/mol. IUPAC: 2-chloro-6H-benzo[c][1,5]benzoxazepine-11-carboxamide.
Chemical Property Profile of SQ 10996
Property Insights of SQ 10996
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SQ 10996. With a topological polar surface area (TPSA) of 55.6 Ų, SQ 10996 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SQ 10996 has 1 hydrogen bond donor(s) and 2 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 SQ 10996?
The CAS number of SQ 10996 is 16802-77-0.
What is the molecular formula of SQ 10996?
The molecular formula of SQ 10996 is C14H11ClN2O2.
What is the molecular weight of SQ 10996?
The molecular weight of SQ 10996 is 274.05 g/mol.
Where can I buy SQ 10996?
You can request a quote for SQ 10996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SQ 10996?
Yes, KEHONG BIO provides custom synthesis services for SQ 10996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.