Nbd-colcemid
TL;DR: Nbd-colcemid (CAS 108964-31-4) is a chemical compound with molecular formula C27H26N4O8 and molecular weight 534.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S)-1,2,3,10-tetramethoxy-7-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one
Also Known As: Nbd-colcemid, Nbd-demecolcin, N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)colcemid, (7S)-1,2,3,10-tetramethoxy-7-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one, (S)-6,7-Dihydro-1,2,3,10-tetramethoxy-7-(methyl(7-nitro-4-benzofurazanyl)amino)benzo(a)heptalen-9(5H)-one
| Molecular Formula | C27H26N4O8 |
|---|---|
| Molecular Weight | 534.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.17505 |
| Heavy Atoms | 39 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 108964-31-4 |
|---|---|
| SMILES | CN([C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC)C4=CC=C(C5=NON=C45)[N+](=O)[O-] |
| InChIKey | DQARLXAFVVPTDP-KRWDZBQOSA-N |
Product Overview
Nbd-colcemid (CAS 108964-31-4), with molecular formula C27H26N4O8 and molecular weight 534.18 g/mol. IUPAC: (7S)-1,2,3,10-tetramethoxy-7-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one.
Chemical Property Profile of Nbd-colcemid
Property Insights of Nbd-colcemid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nbd-colcemid. The TPSA of 142.0 Ų indicates high polarity, suggesting Nbd-colcemid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nbd-colcemid has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nbd-colcemid?
The CAS number of Nbd-colcemid is 108964-31-4.
What is the molecular formula of Nbd-colcemid?
The molecular formula of Nbd-colcemid is C27H26N4O8.
What is the molecular weight of Nbd-colcemid?
The molecular weight of Nbd-colcemid is 534.18 g/mol.
Where can I buy Nbd-colcemid?
You can request a quote for Nbd-colcemid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nbd-colcemid?
Yes, KEHONG BIO provides custom synthesis services for Nbd-colcemid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.