![N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide structure](/static/products/1017/101772-40-1.webp)
N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide
TL;DR: N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide (CAS 101772-40-1) is a chemical compound with molecular formula C17H25N11O3 and molecular weight 431.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-amino-3-iminopropyl)-4-[[4-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylimidazole-2-carboxamide
Also Known As: N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide, 1H-Imidazole-2-carboxamide, 4-[[[4-[[[(aminoiminomethyl)amino]acetyl]amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-N-(3-amino-3-iminopropyl)-1-methyl-, 4-[[[4-[[2-[(Aminoiminomethyl)amino]acetyl]amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-N-(3-amino-3-iminopropyl)-1-methyl-1H-imidazole-2-carboxamide, N-(3-amino-3-iminopropyl)-4-[[4-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylimidazole-2-carboxamide
| Molecular Formula | C17H25N11O3 |
|---|---|
| Molecular Weight | 431.21 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 224.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.21417 |
| Heavy Atoms | 31 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 101772-40-1 |
|---|---|
| SMILES | CN1C=C(C=C1C(=O)NC2=CN(C(=N2)C(=O)NCCC(=N)N)C)NC(=O)CN=C(N)N |
| InChIKey | DNGYUWYULLLFEN-UHFFFAOYSA-N |
Product Overview
N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide (CAS 101772-40-1), with molecular formula C17H25N11O3 and molecular weight 431.21 g/mol. IUPAC: N-(3-amino-3-iminopropyl)-4-[[4-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylimidazole-2-carboxamide.
Chemical Property Profile of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide
Property Insights of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide
The XLogP value of -3.4 indicates that N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 224.0 Ų indicates high polarity, suggesting N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide has 7 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide?
The CAS number of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide is 101772-40-1.
What is the molecular formula of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide?
The molecular formula of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide is C17H25N11O3.
What is the molecular weight of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide?
The molecular weight of N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide is 431.21 g/mol.
Where can I buy N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide?
You can request a quote for N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-amino-3-imino-propyl)-4-[[4-[(2-guanidinoacetyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-imidazole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.