10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine

C250H178N10O5 — CID 167638934

IUPAC10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine
SMILESCc1ccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccc(C)cc4)cc4ccccc4c23)cc1.Cc1cccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4cccc(C)c4)cc4ccccc4c23)c1.Cc1ccccc1N(c1ccccc1)c1cc2ccccc2c2c1oc1c(N(c3ccccc3)c3ccccc3C)cc3ccccc3c12.c1ccc(-c2cccc(N(c3ccccc3)c3cc4ccccc4c4c3oc3c(N(c5ccccc5)c5cccc(-c6ccccc6)c5)cc5ccccc5c34)c2)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccccc4-c4ccccc4)cc4ccccc4c23)cc1
InChIInChI=1S/2C56H38N2O.3C46H34N2O/c1-5-21-39(22-6-1)45-31-17-19-35-49(45)57(43-27-9-3-10-28-43)51-37-41-25-13-15-33-47(41)53-54-48-34-16-14-26-42(48)38-52(56(54)59-55(51)53)58(44-29-11-4-12-30-44)50-36-20-18-32-46(50)40-23-7-2-8-24-40;1-5-19-39(20-6-1)41-25-17-31-47(35-41)57(45-27-9-3-10-28-45)51-37-43-23-13-15-33-49(43)53-54-50-34-16-14-24-44(50)38-52(56(54)59-55(51)53)58(46-29-11-4-12-30-46)48-32-18-26-42(36-48)40-21-7-2-8-22-40;1-31-17-9-15-27-39(31)47(35-21-5-3-6-22-35)41-29-33-19-11-13-25-37(33)43-44-38-26-14-12-20-34(38)30-42(46(44)49-45(41)43)48(36-23-7-4-8-24-36)40-28-16-10-18-32(40)2;1-31-15-13-23-37(27-31)47(35-19-5-3-6-20-35)41-29-33-17-9-11-25-39(33)43-44-40-26-12-10-18-34(40)30-42(46(44)49-45(41)43)48(36-21-7-4-8-22-36)38-24-14-16-32(2)28-38;1-31-21-25-37(26-22-31)47(35-15-5-3-6-16-35)41-29-33-13-9-11-19-39(33)43-44-40-20-12-10-14-34(40)30-42(46(44)49-45(41)43)48(36-17-7-4-8-18-36)38-27-23-32(2)24-28-38/h2*1-38H;3*3-30H,1-2H3
InChIKeyOWSBXMYBEWNRBQ-UHFFFAOYSA-N
MW3402.24 g/mol
LogP72.68
Rot. Bonds34

About 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine

10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine (PubChem CID 167638934) has the molecular formula C250H178N10O5 and a molecular weight of 3402.24 g/mol. Its IUPAC name is 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine.

Molecular Properties

Compound Name10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine
PubChem CID167638934
Molecular FormulaC250H178N10O5
Molecular Weight3402.24 g/mol
Exact Mass3399.40
IUPAC Name10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine
SMILESCc1ccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccc(C)cc4)cc4ccccc4c23)cc1.Cc1cccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4cccc(C)c4)cc4ccccc4c23)c1.Cc1ccccc1N(c1ccccc1)c1cc2ccccc2c2c1oc1c(N(c3ccccc3)c3ccccc3C)cc3ccccc3c12.c1ccc(-c2cccc(N(c3ccccc3)c3cc4ccccc4c4c3oc3c(N(c5ccccc5)c5cccc(-c6ccccc6)c5)cc5ccccc5c34)c2)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccccc4-c4ccccc4)cc4ccccc4c23)cc1
InChIInChI=1S/2C56H38N2O.3C46H34N2O/c1-5-21-39(22-6-1)45-31-17-19-35-49(45)57(43-27-9-3-10-28-43)51-37-41-25-13-15-33-47(41)53-54-48-34-16-14-26-42(48)38-52(56(54)59-55(51)53)58(44-29-11-4-12-30-44)50-36-20-18-32-46(50)40-23-7-2-8-24-40;1-5-19-39(20-6-1)41-25-17-31-47(35-41)57(45-27-9-3-10-28-45)51-37-43-23-13-15-33-49(43)53-54-50-34-16-14-24-44(50)38-52(56(54)59-55(51)53)58(46-29-11-4-12-30-46)48-32-18-26-42(36-48)40-21-7-2-8-22-40;1-31-17-9-15-27-39(31)47(35-21-5-3-6-22-35)41-29-33-19-11-13-25-37(33)43-44-38-26-14-12-20-34(38)30-42(46(44)49-45(41)43)48(36-23-7-4-8-24-36)40-28-16-10-18-32(40)2;1-31-15-13-23-37(27-31)47(35-19-5-3-6-20-35)41-29-33-17-9-11-25-39(33)43-44-40-26-12-10-18-34(40)30-42(46(44)49-45(41)43)48(36-21-7-4-8-22-36)38-24-14-16-32(2)28-38;1-31-21-25-37(26-22-31)47(35-15-5-3-6-16-35)41-29-33-13-9-11-19-39(33)43-44-40-20-12-10-14-34(40)30-42(46(44)49-45(41)43)48(36-17-7-4-8-18-36)38-27-23-32(2)24-28-38/h2*1-38H;3*3-30H,1-2H3
InChIKeyOWSBXMYBEWNRBQ-UHFFFAOYSA-N
XLogP72.68
TPSA98.10 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds34
Heavy Atoms265
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003402.24
LogP ≤ 572.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine?
The IUPAC name of 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine (CID 167638934) is 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine.
What is the SMILES notation for 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine?
The canonical SMILES for 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine is Cc1ccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccc(C)cc4)cc4ccccc4c23)cc1.Cc1cccc(N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4cccc(C)c4)cc4ccccc4c23)c1.Cc1ccccc1N(c1ccccc1)c1cc2ccccc2c2c1oc1c(N(c3ccccc3)c3ccccc3C)cc3ccccc3c12.c1ccc(-c2cccc(N(c3ccccc3)c3cc4ccccc4c4c3oc3c(N(c5ccccc5)c5cccc(-c6ccccc6)c5)cc5ccccc5c34)c2)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2cc3ccccc3c3c2oc2c(N(c4ccccc4)c4ccccc4-c4ccccc4)cc4ccccc4c23)cc1.
What is the InChIKey of 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine?
The InChIKey is OWSBXMYBEWNRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H38N2O.3C46H34N2O/c1-5-21-39(22-6-1)45-31-17-19-35-49(45)57(43-27-9-3-10-28-43)51-37-41-25-13-15-33-47(41)53-54-48-34-16-14-26-42(48)38-52(56(54)59-55(51)53)58(44-29-11-4-12-30-44)50-36-20-18-32-46(50)40-23-7-2-8-24-40;1-5-19-39(20-6-1)41-25-17-31-47(35-41)57(45-27-9-3-10-28-45)51-37-43-23-13-15-33-49(43)53-54-50-34-16-14-24-44(50)38-52(56(54)59-55(51)53)58(46-29-11-4-12-30-46)48-32-18-26-42(36-48)40-21-7-2-8-22-40;1-31-17-9-15-27-39(31)47(35-21-5-3-6-22-35)41-29-33-19-11-13-25-37(33)43-44-38-26-14-12-20-34(38)30-42(46(44)49-45(41)43)48(36-23-7-4-8-24-36)40-28-16-10-18-32(40)2;1-31-15-13-23-37(27-31)47(35-19-5-3-6-20-35)41-29-33-17-9-11-25-39(33)43-44-40-26-12-10-18-34(40)30-42(46(44)49-45(41)43)48(36-21-7-4-8-22-36)38-24-14-16-32(2)28-38;1-31-21-25-37(26-22-31)47(35-15-5-3-6-16-35)41-29-33-13-9-11-19-39(33)43-44-40-20-12-10-14-34(40)30-42(46(44)49-45(41)43)48(36-17-7-4-8-18-36)38-27-23-32(2)24-28-38/h2*1-38H;3*3-30H,1-2H3.
What are the key properties of 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine?
10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine has a molecular weight of 3402.24 g/mol, XLogP of 72.68, 34 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 10-N,14-N-bis(2-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(3-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-bis(4-methylphenyl)-10-N,14-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine;10-N,14-N-diphenyl-10-N,14-N-bis(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-10,14-diamine is sourced from PubChem (CID 167638934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).