NCI60_015033
TL;DR: NCI60_015033 (CAS 143140-12-9) is a chemical compound with molecular formula C19H26N2O2 and molecular weight 314.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,5S,8R)-10-benzyl-2-methyl-5-propan-2-yl-3-oxa-6,10-diazatricyclo[6.3.0.02,6]undecan-7-one
Also Known As: NCI60_015033, (3aalpha)-2-Benzyl-3balpha-methyl-6alpha-isopropylhexahydro-2,6a-diaza-4-oxa-1H-cyclopenta[a]pentalen-7(7aalphaH)-one, (3S,5aR,8aS,8bR)-7-benzyl-8b-methyl-3-(propan-2-yl)octahydro-5H-pyrrolo[3',4':3,4]pyrrolo[2,1-b][1,3]oxazol-5-one, (1S,2R,5S,8R)-10-benzyl-2-methyl-5-(propan-2-yl)-3-oxa-6,10-diazatricyclo[6.3.0.02,6]undecan-7-one, 5H-Pyrrolo[3a(2),4a(2):3,4]pyrrolo[2,1-b]oxazol-5-one, octahydro-8b-methyl-3-(1-methylethyl)-7-(phenylmethyl)-, [3S-(3I+/-,5aI+/-,8aI+/-,8bI+/-)]-
| Molecular Formula | C19H26N2O2 |
|---|---|
| Molecular Weight | 314.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.19943 |
| Heavy Atoms | 23 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 143140-12-9 |
|---|---|
| SMILES | CC(C)[C@H]1CO[C@]2(N1C(=O)[C@@H]3[C@H]2CN(C3)CC4=CC=CC=C4)C |
| InChIKey | UEVPYIDZJWMMTF-DODZYUBVSA-N |
Product Overview
NCI60_015033 (CAS 143140-12-9), with molecular formula C19H26N2O2 and molecular weight 314.20 g/mol. IUPAC: (1S,2R,5S,8R)-10-benzyl-2-methyl-5-propan-2-yl-3-oxa-6,10-diazatricyclo[6.3.0.02,6]undecan-7-one.
Chemical Property Profile of NCI60_015033
Property Insights of NCI60_015033
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCI60_015033. With a topological polar surface area (TPSA) of 32.8 Ų, NCI60_015033 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NCI60_015033 has 0 hydrogen bond donor(s) and 3 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 NCI60_015033?
The CAS number of NCI60_015033 is 143140-12-9.
What is the molecular formula of NCI60_015033?
The molecular formula of NCI60_015033 is C19H26N2O2.
What is the molecular weight of NCI60_015033?
The molecular weight of NCI60_015033 is 314.20 g/mol.
Where can I buy NCI60_015033?
You can request a quote for NCI60_015033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_015033?
Yes, KEHONG BIO provides custom synthesis services for NCI60_015033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.