![N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide structure](/static/products/562/5627-52-1.png)
N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide
TL;DR: N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide (CAS 5627-52-1) is a chemical compound with molecular formula C12H13N7O3 and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide
Also Known As: N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide, N-[1-(5-NITROTETRAZOL-2-YL)PROPAN-2-YLIDENEAMINO]-2-PHENYL-ACETAMIDE, Pyrrolidine, 3-[(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)methyl]-1-methyl-, hydrochloride
| Molecular Formula | C12H13N7O3 |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.108 |
| Heavy Atoms | 22 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 5627-52-1 |
|---|---|
| SMILES | CC(=NNC(=O)CC1=CC=CC=C1)CN2N=C(N=N2)[N+](=O)[O-] |
| InChIKey | AJRVISMZMDWJQB-UHFFFAOYSA-N |
Product Overview
N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide (CAS 5627-52-1), with molecular formula C12H13N7O3 and molecular weight 303.11 g/mol. IUPAC: N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide.
Chemical Property Profile of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide
Property Insights of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide. Following Lipinski's Rule of Five, N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide has 1 hydrogen bond donor(s) and 7 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 N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide?
The CAS number of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide is 5627-52-1.
What is the molecular formula of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide?
The molecular formula of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide is C12H13N7O3.
What is the molecular weight of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide?
The molecular weight of N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide is 303.11 g/mol.
Where can I buy N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide?
You can request a quote for N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.