3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide
TL;DR: 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide (CAS 87453-63-2) is a chemical compound with molecular formula C16H31Cl2N3O3P and molecular weight 414.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 3-Otp-cyclophosphamide, KST-1A8670, N,N-bis(2-chloroethyl)-3-(1-, 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide, (4-{2-[bis(2-chloroethyl)amino]-2-oxido-1,3,2-oxazaphosphinan-3-yl}-2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl
| Molecular Formula | C16H31Cl2N3O3P |
|---|---|
| Molecular Weight | 414.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 37.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.148 |
| Heavy Atoms | 25 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 87453-63-2 |
|---|---|
| SMILES | CC1(CC(CC(N1[O])(C)C)N2CCCOP2(=O)N(CCCl)CCCl)C |
| InChIKey | ULWHZDRBRAFXCX-UHFFFAOYSA-N |
Product Overview
3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide (CAS 87453-63-2), with molecular formula C16H31Cl2N3O3P and molecular weight 414.15 g/mol.
Chemical Property Profile of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide
Property Insights of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide. With a topological polar surface area (TPSA) of 37.0 Ų, 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide has 0 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 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide?
The CAS number of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide is 87453-63-2.
What is the molecular formula of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide?
The molecular formula of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide is C16H31Cl2N3O3P.
What is the molecular weight of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide?
The molecular weight of 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide is 414.15 g/mol.
Where can I buy 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide?
You can request a quote for 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Oxy-2,2,6,6-tetramethyl-4-piperidinyl)cyclophosphamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.