6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine

C66H92Cl8N30O6 — CID 157204411

IUPAC6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine
SMILESCN1CCN(c2nc(NCCN3CCOCC3)c3nc(Cl)c(NCCN4CCOCC4)nc3n2)CC1.Cc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1.Clc1nc(Cl)c2nc(Cl)c(Cl)nc2n1.Clc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1
InChIInChI=1S/C23H37ClN10O2.C19H29ClN8O2.C18H26Cl2N8O2.C6Cl4N4/c1-31-6-8-34(9-7-31)23-29-20(25-2-4-32-10-14-35-15-11-32)18-21(30-23)28-22(19(24)27-18)26-3-5-33-12-16-36-17-13-33;1-14-23-17(21-2-4-27-6-10-29-11-7-27)15-18(24-14)26-19(16(20)25-15)22-3-5-28-8-12-30-13-9-28;19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27;7-2-1-5(14-6(10)13-2)12-4(9)3(8)11-1/h2-17H2,1H3,(H2,25,26,28,29,30);2-13H2,1H3,(H2,21,22,23,24,26);1-12H2,(H2,21,22,24,25,26);
InChIKeyAREJMNMSHNYAFC-UHFFFAOYSA-N
MW1685.29 g/mol
LogP5.43
Rot. Bonds25

About 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine

6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine (PubChem CID 157204411) has the molecular formula C66H92Cl8N30O6 and a molecular weight of 1685.29 g/mol. Its IUPAC name is 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine.

Molecular Properties

Compound Name6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine
PubChem CID157204411
Molecular FormulaC66H92Cl8N30O6
Molecular Weight1685.29 g/mol
Exact Mass1680.53
IUPAC Name6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine
SMILESCN1CCN(c2nc(NCCN3CCOCC3)c3nc(Cl)c(NCCN4CCOCC4)nc3n2)CC1.Cc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1.Clc1nc(Cl)c2nc(Cl)c(Cl)nc2n1.Clc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1
InChIInChI=1S/C23H37ClN10O2.C19H29ClN8O2.C18H26Cl2N8O2.C6Cl4N4/c1-31-6-8-34(9-7-31)23-29-20(25-2-4-32-10-14-35-15-11-32)18-21(30-23)28-22(19(24)27-18)26-3-5-33-12-16-36-17-13-33;1-14-23-17(21-2-4-27-6-10-29-11-7-27)15-18(24-14)26-19(16(20)25-15)22-3-5-28-8-12-30-13-9-28;19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27;7-2-1-5(14-6(10)13-2)12-4(9)3(8)11-1/h2-17H2,1H3,(H2,25,26,28,29,30);2-13H2,1H3,(H2,21,22,23,24,26);1-12H2,(H2,21,22,24,25,26);
InChIKeyAREJMNMSHNYAFC-UHFFFAOYSA-N
XLogP5.43
TPSA359.72 Ų
H-Bond Donors6
H-Bond Acceptors36
Rotatable Bonds25
Heavy Atoms110
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001685.29
LogP ≤ 55.43
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1036

Analyze 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine with MolForge

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Related Compounds

6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;ethane
CID 145022023
6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis[2-(4-methylpiperazin-1-yl)ethyl]pteridine-4,7-diamine
CID 118892615
2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
CID 118892550
6-chloro-2-methylsulfinyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
CID 118892576
4-chloro-6-methyl-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
CID 143985982
6-N-ethyl-2,5-dimethyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 80778253
7-(4-methylpiperazin-1-yl)-4-N,6-N-bis(2-morpholin-4-ylethyl)-2-phenylpteridine-4,6-diamine
CID 71111903
3,6-dichloro-N-(3-morpholin-4-ylpropyl)-1,2,4-triazin-5-amine
CID 81035323
6,7-dichloro-2-methylsulfonyl-N-(2-piperidin-1-ylethyl)pteridin-4-amine
CID 130466479
2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-7H-purin-6-amine
CID 117081727
2,5,6-trimethyl-N-(2-morpholin-4-ylethyl)thieno[2,3-d]pyrimidin-4-amine
CID 23740566
6,7-dimethyl-2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(4-morpholin-4-ylbutyl)pteridin-4-amine
CID 71479252

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine?
The IUPAC name of 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine (CID 157204411) is 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine.
What is the SMILES notation for 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine?
The canonical SMILES for 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine is CN1CCN(c2nc(NCCN3CCOCC3)c3nc(Cl)c(NCCN4CCOCC4)nc3n2)CC1.Cc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1.Clc1nc(Cl)c2nc(Cl)c(Cl)nc2n1.Clc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1.
What is the InChIKey of 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine?
The InChIKey is AREJMNMSHNYAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37ClN10O2.C19H29ClN8O2.C18H26Cl2N8O2.C6Cl4N4/c1-31-6-8-34(9-7-31)23-29-20(25-2-4-32-10-14-35-15-11-32)18-21(30-23)28-22(19(24)27-18)26-3-5-33-12-16-36-17-13-33;1-14-23-17(21-2-4-27-6-10-29-11-7-27)15-18(24-14)26-19(16(20)25-15)22-3-5-28-8-12-30-13-9-28;19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27;7-2-1-5(14-6(10)13-2)12-4(9)3(8)11-1/h2-17H2,1H3,(H2,25,26,28,29,30);2-13H2,1H3,(H2,21,22,23,24,26);1-12H2,(H2,21,22,24,25,26);.
What are the key properties of 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine?
6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine has a molecular weight of 1685.29 g/mol, XLogP of 5.43, 25 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine is sourced from PubChem (CID 157204411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).