卡莫司汀
TL;DR: 卡莫司汀 (CAS 154-93-8) is a chemical compound with molecular formula C5H9Cl2N3O2 and molecular weight 213.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
卡莫司汀
1,3-bis(2-chloroethyl)-1-nitrosourea
Also Known As: carmustine, Carmustin, Nitrumon, BCNU, Gliadel
| Molecular Formula | C5H9Cl2N3O2 |
|---|---|
| Molecular Weight | 213.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 213.00719 |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
| Melting Point | 86 to 32.2 °C |
| Solubility | less than 1 mg/mL at 64 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 154-93-8 |
|---|---|
| SMILES | C(CCl)NC(=O)N(CCCl)N=O |
| InChIKey | DLGOEMSEDOSKAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
卡莫司汀 (CAS 154-93-8), with molecular formula C5H9Cl2N3O2 and molecular weight 213.01 g/mol. IUPAC: 1,3-bis(2-chloroethyl)-1-nitrosourea.
Chemical Property Profile of 卡莫司汀
Property Insights of 卡莫司汀
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 卡莫司汀. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 卡莫司汀. Following Lipinski's Rule of Five, 卡莫司汀 has 1 hydrogen bond donor(s) and 3 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 卡莫司汀?
The CAS number of 卡莫司汀 is 154-93-8.
What is the molecular formula of 卡莫司汀?
The molecular formula of 卡莫司汀 is C5H9Cl2N3O2.
What is the molecular weight of 卡莫司汀?
The molecular weight of 卡莫司汀 is 213.01 g/mol.
Where can I buy 卡莫司汀?
You can request a quote for 卡莫司汀 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 卡莫司汀?
Yes, KEHONG BIO provides custom synthesis services for 卡莫司汀 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.