8017-2361 Screening compound: 1,3-dimethyl-6,7-dinitro-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Chemical Structure Depiction of ChemDiv screening compound 8017-2361
1,3-dimethyl-6,7-dinitro-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
8017-2361
Molecular Formula
C8H7N5O6 (C8 H7 N5 O6)
Compound Name
1,3-dimethyl-6,7-dinitro-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
IUPAC name
13-dimethyl-67-dinitro-1H2H3H4H5H-pyrrolo[32-d]pyrimidine-24-dione
SMILES
CN(c1c(C(N2C)=O)[nH]c([N+]([O-])=O)c1[N+]([O-])=O)C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
269.17
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
11
Partition Coefficient, logP
0.576
Distribution Coefficient, logD
-1.678
Water Solubility, LogSw
-0.84
Polar Surface Area
109.088
Acid Dissociation Constant (pKa)
0.01
Base Dissociation Constant (pKb)
-4.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
25.00
References: we are preparing a list of scientific research reports with 8017-2361 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)