(C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-
TL;DR: (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- (CAS 42402-37-9) is a chemical compound with molecular formula C23H28N2O7 and molecular weight 444.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;2-methyloxirane;oxirane;propane-1,2,3-triol
Also Known As: (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-, 1,2,3-Propanetriol, polymer with 1,1'-methylenebis(4-isocyanatobenzene), methyloxirane and oxirane, 1,2,3-Propanetriol, polymer with 1,1'-methylenebis[4-isocyanatobenzene], methyloxirane and oxirane, 1,2,3-Propanetriol, polymer with 1,1'-methylenebis(4-isocyanatobenzene), 2-methyloxirane and oxirane, 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene; 2-methyloxirane; oxirane; propane-1,2,3-triol
| Molecular Formula | C23H28N2O7 |
|---|---|
| Molecular Weight | 444.19 g/mol |
| LogP | 1.9656 |
| Topological Polar Surface Area | 144.61 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.18964 |
| Heavy Atoms | 32 |
| Complexity | 786.6637 |
Chemical Identifiers
| CAS Number | 42402-37-9 |
|---|---|
| SMILES | CC1CO1.C1CO1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(C(CO)O)O |
Product Overview
(C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- (CAS 42402-37-9), with molecular formula C23H28N2O7 and molecular weight 444.19 g/mol. IUPAC: 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;2-methyloxirane;oxirane;propane-1,2,3-triol.
Chemical Property Profile of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-
Property Insights of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-
The XLogP value of 1.9656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-. The TPSA of 144.61 Ų indicates high polarity, suggesting (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- has 3 hydrogen bond donor(s) and 9 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 (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-?
The CAS number of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- is 42402-37-9.
What is the molecular formula of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-?
The molecular formula of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- is C23H28N2O7.
What is the molecular weight of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-?
The molecular weight of (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- is 444.19 g/mol.
Where can I buy (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-?
You can request a quote for (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x-?
Yes, KEHONG BIO provides custom synthesis services for (C15-H10-N2-O2.C3-H8-O3.C3-H6-O.C2-H4-O)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.