N(sup 1)-(2-Aminopropyl)bleomycinamide
TL;DR: N(sup 1)-(2-Aminopropyl)bleomycinamide (CAS 62841-16-1) is a chemical compound with molecular formula C53H80N18O21S2 and molecular weight 1368.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[5-[[1-[2-[4-[4-(2-aminopropylcarbamoyl)-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate
Also Known As: DAP-BLM, N(sup 1)-(2-Aminopropyl)bleomycinamide, Bleomycinamide, N1-(2-aminopropyl)-, Bleomycinamide, N(sup 1)-(2-aminopropyl)-, [2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[5-[[1-[2-[4-[4-(2-aminopropylcarbamoyl)-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate
| Molecular Formula | C53H80N18O21S2 |
|---|---|
| Molecular Weight | 1368.52 g/mol |
| LogP | -8.62438 |
| Topological Polar Surface Area | 653.09 Ų |
| Hydrogen Bond Donors | 21 |
| Hydrogen Bond Acceptors | 32 |
| Rotatable Bonds | 33 |
| Exact Mass | 1368.5187 |
| Heavy Atoms | 94 |
| Complexity | 3239.4937 |
Chemical Identifiers
| CAS Number | 62841-16-1 |
|---|---|
| SMILES | CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCC(C)N)O |
Product Overview
N(sup 1)-(2-Aminopropyl)bleomycinamide (CAS 62841-16-1), with molecular formula C53H80N18O21S2 and molecular weight 1368.52 g/mol. IUPAC: [2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[5-[[1-[2-[4-[4-(2-aminopropylcarbamoyl)-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate.
Chemical Property Profile of N(sup 1)-(2-Aminopropyl)bleomycinamide
Property Insights of N(sup 1)-(2-Aminopropyl)bleomycinamide
The XLogP value of -8.62438 indicates that N(sup 1)-(2-Aminopropyl)bleomycinamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 653.09 Ų indicates high polarity, suggesting N(sup 1)-(2-Aminopropyl)bleomycinamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(sup 1)-(2-Aminopropyl)bleomycinamide has 21 hydrogen bond donor(s) and 32 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N(sup 1)-(2-Aminopropyl)bleomycinamide?
The CAS number of N(sup 1)-(2-Aminopropyl)bleomycinamide is 62841-16-1.
What is the molecular formula of N(sup 1)-(2-Aminopropyl)bleomycinamide?
The molecular formula of N(sup 1)-(2-Aminopropyl)bleomycinamide is C53H80N18O21S2.
What is the molecular weight of N(sup 1)-(2-Aminopropyl)bleomycinamide?
The molecular weight of N(sup 1)-(2-Aminopropyl)bleomycinamide is 1368.52 g/mol.
Where can I buy N(sup 1)-(2-Aminopropyl)bleomycinamide?
You can request a quote for N(sup 1)-(2-Aminopropyl)bleomycinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(sup 1)-(2-Aminopropyl)bleomycinamide?
Yes, KEHONG BIO provides custom synthesis services for N(sup 1)-(2-Aminopropyl)bleomycinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.