2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride
TL;DR: 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride (CAS 37402-19-0) is a chemical compound with molecular formula C17H27ClN6O3 and molecular weight 398.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(1-cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine;hydrochloride
Also Known As: 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride
| Molecular Formula | C17H27ClN6O3 |
|---|---|
| Molecular Weight | 398.18 g/mol |
| LogP | 1.4212 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.18332 |
| Heavy Atoms | 27 |
| Complexity | 661.0 |
Chemical Identifiers
| CAS Number | 37402-19-0 |
|---|---|
| SMILES | CC(=NN=C(N)N)CC1(C(=O)NC(=O)N(C1=O)C2CCCCC2)CC=C.Cl |
| InChIKey | SWRBHSFNYIMFRL-UHFFFAOYSA-N |
Product Overview
2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride (CAS 37402-19-0), with molecular formula C17H27ClN6O3 and molecular weight 398.18 g/mol. IUPAC: 2-[1-(1-cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine;hydrochloride.
Chemical Property Profile of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride
Property Insights of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride
The XLogP value of 1.4212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride. The TPSA of 143.0 Ų indicates high polarity, suggesting 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride has 4 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 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride?
The CAS number of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride is 37402-19-0.
What is the molecular formula of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride?
The molecular formula of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride is C17H27ClN6O3.
What is the molecular weight of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride?
The molecular weight of 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride is 398.18 g/mol.
Where can I buy 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride?
You can request a quote for 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(1-Cyclohexyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.