Toluene, 2,3-bis(aziridinocarbonylamino)-
TL;DR: Toluene, 2,3-bis(aziridinocarbonylamino)- (CAS 63869-88-5) is a chemical compound with molecular formula C13H18N6O2 and molecular weight 290.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methylphenyl]urea
Also Known As: Toluene, 2,3-bis(aziridinocarbonylamino)-, 2,3-Bis(3,3-ethyleniminoureido)-toluene, N,N'-(3-Methyl-1,2-phenylene)bis[N'-(aziridin-1-yl)urea], Urea, N,N''-(3-methyl-1,2-phenylene)bis[N'-1-aziridinyl-, 1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methylphenyl]urea
| Molecular Formula | C13H18N6O2 |
|---|---|
| Molecular Weight | 290.15 g/mol |
| LogP | 0.69922 |
| Topological Polar Surface Area | 88.28 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.1491 |
| Heavy Atoms | 21 |
| Complexity | 567.77997 |
Chemical Identifiers
| CAS Number | 63869-88-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)NN2CC2)NC(=O)NN3CC3 |
Product Overview
Toluene, 2,3-bis(aziridinocarbonylamino)- (CAS 63869-88-5), with molecular formula C13H18N6O2 and molecular weight 290.15 g/mol. IUPAC: 1-(aziridin-1-yl)-3-[2-(aziridin-1-ylcarbamoylamino)-3-methylphenyl]urea.
Chemical Property Profile of Toluene, 2,3-bis(aziridinocarbonylamino)-
Property Insights of Toluene, 2,3-bis(aziridinocarbonylamino)-
The XLogP value of 0.69922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Toluene, 2,3-bis(aziridinocarbonylamino)-. The TPSA of 88.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Toluene, 2,3-bis(aziridinocarbonylamino)-. Following Lipinski's Rule of Five, Toluene, 2,3-bis(aziridinocarbonylamino)- has 4 hydrogen bond donor(s) and 4 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 Toluene, 2,3-bis(aziridinocarbonylamino)-?
The CAS number of Toluene, 2,3-bis(aziridinocarbonylamino)- is 63869-88-5.
What is the molecular formula of Toluene, 2,3-bis(aziridinocarbonylamino)-?
The molecular formula of Toluene, 2,3-bis(aziridinocarbonylamino)- is C13H18N6O2.
What is the molecular weight of Toluene, 2,3-bis(aziridinocarbonylamino)-?
The molecular weight of Toluene, 2,3-bis(aziridinocarbonylamino)- is 290.15 g/mol.
Where can I buy Toluene, 2,3-bis(aziridinocarbonylamino)-?
You can request a quote for Toluene, 2,3-bis(aziridinocarbonylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Toluene, 2,3-bis(aziridinocarbonylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Toluene, 2,3-bis(aziridinocarbonylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.